Receptor
PDB id Resolution Class Description Source Keywords
4COQ 1.55 Å EC: 4.2.1.1 THE COMPLEX OF ALPHA-CARBONIC ANHYDRASE FROM THERMOVIBRIO AMMONIFICANS WITH INHIBITOR SULFANILAMIDE. THERMOVIBRIO AMMONIFICANS LYASE
Ref.: THE STRUCTURE OF A TETRAMERIC [ALPHA]-CARBONIC ANHY FROM THERMOVIBRIO AMMONIFICANS REVEALS A CORE FORME INTERMOLECULAR DISULFIDES THAT CONTRIBUTE TO ITS THERMOSTABILITY ACTA CRYSTALLOGR.,SECT.D V. 70 2607 2014
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
PG6 A:303;
B:302;
A:302;
A:306;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
submit data
266.331 C12 H26 O6 COCCO...
PGE B:307;
A:305;
Invalid;
Invalid;
none;
none;
submit data
150.173 C6 H14 O4 C(COC...
ZN B:299;
A:299;
Part of Protein;
Part of Protein;
none;
none;
submit data
65.409 Zn [Zn+2...
SAN A:300;
B:300;
Valid;
Valid;
none;
none;
submit data
172.205 C6 H8 N2 O2 S c1cc(...
PG4 A:304;
Invalid;
none;
submit data
194.226 C8 H18 O5 C(COC...
CL B:1248;
Invalid;
none;
submit data
35.453 Cl [Cl-]
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
4COQ 1.55 Å EC: 4.2.1.1 THE COMPLEX OF ALPHA-CARBONIC ANHYDRASE FROM THERMOVIBRIO AMMONIFICANS WITH INHIBITOR SULFANILAMIDE. THERMOVIBRIO AMMONIFICANS LYASE
Ref.: THE STRUCTURE OF A TETRAMERIC [ALPHA]-CARBONIC ANHY FROM THERMOVIBRIO AMMONIFICANS REVEALS A CORE FORME INTERMOLECULAR DISULFIDES THAT CONTRIBUTE TO ITS THERMOSTABILITY ACTA CRYSTALLOGR.,SECT.D V. 70 2607 2014
Members (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 16 families.
1 4COQ - SAN C6 H8 N2 O2 S c1cc(ccc1N....
2 4UOV - AZM C4 H6 N4 O3 S2 CC(=O)Nc1n....
70% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 11 families.
1 4COQ - SAN C6 H8 N2 O2 S c1cc(ccc1N....
2 4UOV - AZM C4 H6 N4 O3 S2 CC(=O)Nc1n....
50% Homology Family (435)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 4 families.
1 3K34 - SUA C13 H14 N2 O3 S3 c1cc(ccc1N....
2 4XE1 Ki = 77.3 nM IL5 C7 H6 N2 O5 S2 c1cc2c(cc1....
3 5JG3 - EVF C7 H6 N2 O2 S2 c1ccc2c(c1....
4 4HT0 Kd = 10 nM V50 C12 H9 F4 N3 O2 S2 Cc1cc(nc(n....
5 1IF8 Kd = 230 pM SBS C19 H21 N3 O3 S C[C@@H](CN....
6 1I9L Kd = 3.3 nM INV C14 H13 F N2 O3 S c1cc(ccc1C....
7 3VBD Ki = 8.6 nM 0FZ C16 H16 N2 O3 S COc1ccc2c(....
8 3M5E Kd = 0.043 uM JDR C13 H13 Cl N4 O3 S2 CSc1nc(c(c....
9 3P5A Ki = 0.95 nM IT2 C5 H9 N O S2 C1COCCN1C(....
10 2AW1 Ki = 43 nM COX C16 H14 N2 O3 S Cc1c(c(no1....
11 4M2W - ETS C10 H16 N2 O4 S3 CCN[C@H]1C....
12 5J8Z Ki = 5 nM FC4 C20 H16 Cl N5 O4 S2 C[C@H](C(=....
13 4QTL Kd = 120 nM WWO C15 H15 F3 N2 O5 S2 c1ccc(cc1)....
14 5BYI Ki = 30.7 nM 4WA C12 H12 N4 O2 S c1cc(ccc1N....
15 4PYX Kd = 910 nM V90 C16 H23 F3 N2 O3 S2 C1CCCC(CCC....
16 5FLT Kd = 1280 uM VJJ C13 H10 O3 c1ccc(cc1)....
17 4RIV - LSA C7 H5 N O3 S c1ccc2c(c1....
18 5EKM Kd = 0.48 uM TG5 C12 H19 N3 O3 S CCCCNCC(=O....
19 3MHC Ki = 11 nM ARZ C13 H18 N4 O3 S2 C1C2CC3CC1....
20 5L6K - QUK QVS 6H0 QUJ QVE n/a n/a
21 3M96 Kd = 0.06 uM E38 C15 H11 Br Cl N3 O3 S2 c1cc(c(cc1....
22 4ITP Ki = 54 nM 1GD C15 H16 N2 O3 S c1ccc(cc1)....
23 2GD8 ic50 = 379 nM PO1 C19 H28 N2 O7 S2 C[C@]12CC[....
24 5G03 - OE2 C11 H14 Br N3 O5 S c1cc(c(cc1....
25 4QSI Kd = 50 nM EWZ C16 H18 Cl N3 O4 S2 CC(C)(C)C1....
26 1BNV Kd = 1.7 nM AL7 C14 H17 N3 O5 S3 CN[C@@H]1C....
27 1I9Q Kd = 3.9 nM IOF C14 H11 F3 N2 O3 S c1cc(ccc1C....
28 2Q1Q Ki = 7 nM OSP C10 H14 N2 O4 S2 c1cc(ccc1N....
29 5LJT Ki = 1.2 nM A6N C15 H16 N4 O3 S c1ccc(cc1)....
30 1G0E - 4MZ C4 H6 N2 Cc1c[nH]cn....
31 4QIY Kd = 50 nM WWX C22 H21 F3 N2 O6 S2 c1ccc(cc1)....
32 2OSF ic50 ~ 148 uM TH0 C6 H6 O2 S c1cc(c(cc1....
33 5BRV Kd = 0.96 nM 9TH C28 H31 Cl Ir N3 O4 S2 C[C-]12C3(....
34 5U0E Kd = 7.7 uM 7R4 C10 H9 N O S2 c1ccc(cc1)....
35 4PYY Kd = 29 nM V14 C16 H23 F3 N2 O5 S2 C1CCCC(CCC....
36 1G45 Kd = 2.3 nM FSB C14 H13 F N2 O3 S c1ccc(c(c1....
37 5FNK Kd = 1005 uM 5OO C9 H6 Cl2 O2 c1cc(c(cc1....
38 2NNO Kd = 0.4 uM M28 C9 H11 N O4 S c1cc(ccc1C....
39 4Q81 Ki = 950 uM 7MH C7 H9 N O S CC1=CC(=S)....
40 3CA2 - AMS C6 H7 Hg N2 O2 S c1cc(c(cc1....
41 4Q7P Ki = 48 uM 3MH C6 H7 N O S CC1=CC=CN(....
42 4YYT Kd = 428.6 nM S2O C8 H11 N O3 S c1cc(ccc1C....
43 5E2K Ki = 9.3 nM BX4 C12 H12 N2 O2 S c1cc(cc(c1....
44 3M2N - J74 C12 H12 Cl N5 O4 S c1cc(ccc1C....
45 3OYS Ki = 9 nM OYS C14 H14 N2 O3 S c1ccc(cc1)....
46 3RYZ Kd = 2.4 nM RYZ C11 H9 F7 N2 O3 S c1cc(ccc1C....
47 4M2V - BZ1 C12 H21 N3 O5 S3 CCN[C@H]1C....
48 3S8X Kd = 0.07 uM E59 C13 H13 N3 O4 S2 CC1=CC(=O)....
49 5U0G - 7QY C12 H13 N O4 S COc1ccc(c(....
50 3K7K Kd ~ 8.86 nM KCS C H2 S3 C(=S)(S)S
51 3T83 Ki = 105 nM MG5 C15 H25 N O11 S CCC(=O)O[C....
52 3BL1 Ki = 2520 nM BL1 C16 H16 Cl N3 O3 S C[C@H]1Cc2....
53 5EH7 Kd = 330 uM 5O5 C8 H6 Cl2 N4 O c1cc(c(cc1....
54 4RUY Ki = 12.8 nM 3W6 C9 H13 N O3 S CCCOc1ccc(....
55 3MHO Kd = 0.32 uM J43 C12 H11 Cl N4 O3 S2 CSc1nc(c(c....
56 4YX4 Kd = 1135.3 nM FB2 C6 H7 N O2 S c1ccc(cc1)....
57 4N16 ic50 = 0.22 mM CHD C24 H40 O5 C[C@H](CCC....
58 3K2F Ki = 63 nM NKX C14 H20 N4 O12 S3 CCN([C@H]1....
59 2WEO Kd = 118 nM FBW C6 H6 F N O2 S c1cc(cc(c1....
60 3PO6 - DT9 C12 H18 N2 O4 S C[C@H]1c2c....
61 3V7X Ki = 2.7 nM D7A C17 H20 N2 O5 S COc1ccc(cc....
62 3IBU Ki = 0.7 nM O48 C10 H23 N O3 S CCCCCCCCCC....
63 1BNT Kd = 0.16 nM AL2 C13 H14 N2 O6 S3 COc1ccc(cc....
64 4YXU Kd = 60.6 nM 4JE C9 H13 N O2 S CCCc1ccc(c....
65 4Q09 Kd = 6.7 nM V14 C16 H23 F3 N2 O5 S2 C1CCCC(CCC....
66 5FLS Kd = 905 uM 6ZX C10 H9 Cl O2 C/C(=CC(=O....
67 3DCS Ki = 11.4 nM MZM C5 H8 N4 O3 S2 CC(=O)/N=C....
68 5TYA Kd = 32.9 uM 7QS C9 H7 N O2 S c1ccc(cc1)....
69 3RYV Kd = 86 nM RYV C9 H12 N2 O3 S CCNC(=O)c1....
70 2WEJ Kd = 839 nM FB2 C6 H7 N O2 S c1ccc(cc1)....
71 3MYQ Kd = 0.03 uM E27 C18 H13 Cl N4 O3 S2 c1ccc2c(c1....
72 4ZWZ - 510 C12 H22 N2 O12 S2 COC(=O)[C@....
73 4Q6D Kd = 0.0435 uM WW3 C12 H18 N4 O2 S c1cc(ccc1/....
74 3V5G Ki = 74 nM 0F3 C6 H9 N3 O4 S2 c1cc(ccc1N....
75 1EOU ic50 = 36 nM SMS C9 H15 N O10 S2 CC1(O[C@H]....
76 4RFC Ki = 5.7 nM 3O1 C15 H24 N2 O5 S CC(C)(C)OC....
77 5VGY Kd = 65.5 uM 9AA C12 H14 N2 O4 S COc1ccc(c(....
78 1BN4 Kd = 0.49 nM AL9 C12 H14 N2 O5 S3 COc1ccc(cc....
79 1G4O Kd = 5.6 nM BSB C14 H14 N2 O3 S c1ccc(cc1)....
80 5SZ3 Ki = 2.5 nM 72H C15 H12 N2 O2 S c1ccc2c(c1....
81 4RUZ - 3W8 C8 H11 N O3 S CCOc1ccc(c....
82 3KIG ic50 = 245 nM DA4 C8 H7 N O2 S C#Cc1cccc(....
83 5SZ5 - 72E C13 H13 N O2 S Cc1ccccc1c....
84 3EFI - TRP C11 H12 N2 O2 c1ccc2c(c1....
85 3N0N Ki = 50 nM P9B C13 H8 F5 N3 O3 S c1cc(ccc1N....
86 4Q06 Kd = 15 nM V90 C16 H23 F3 N2 O3 S2 C1CCCC(CCC....
87 2X7T Ki = 232 nM WZB C20 H30 N2 O6 S2 CCc1cc2c(c....
88 4Z1J Kd = 7.7 nM 4KC C16 H16 N2 O3 S c1ccc2c(c1....
89 5U0F Kd = 3.4 uM 7R1 C12 H13 N O3 S2 COc1ccc(c(....
90 3T5Z Ki = 8.96 uM B09 C7 H9 N O3 S CONS(=O)(=....
91 4FIK - TH0 C6 H6 O2 S c1cc(c(cc1....
92 4E3D Ki = 5 mM GTQ C7 H6 O4 c1cc(c(cc1....
93 1G46 Kd = 1.6 nM F2B C14 H12 F2 N2 O3 S c1cc(c(c(c....
94 5JEP - EVF C7 H6 N2 O2 S2 c1ccc2c(c1....
95 3IBL Ki = 14.6 nM O59 C8 H20 N2 O6 S2 C(CCCCOS(=....
96 5CLU Ki = 78 uM S8A C9 H7 N O5 S c1ccc2c(c1....
97 5FLR Kd = 1.35 uM XCZ C5 H7 N3 O2 S Cc1ccnc(n1....
98 5EKH Kd = 1.11 uM 5RD C11 H18 N2 O2 S CCCCNCc1cc....
99 5JG5 - EVF C7 H6 N2 O2 S2 c1ccc2c(c1....
100 1IF6 - FBU C6 H5 F2 N O2 S c1c(cc(cc1....
101 2O4Z Ki = 566 nM HSW H4 N2 O3 S NS(=O)(=O)....
102 3T84 Ki = 106 nM SG6 C8 H15 N O9 S CC(=O)O[C@....
103 4Q78 - 25X C3 H5 B10 N2 O2 S B1234B567B....
104 5EH8 Kd = 791 uM 5O6 C11 H12 O3 C/C(=CC(=O....
105 5JGT - EVI C3 H4 N2 O2 S2 c1csc(n1)S....
106 2WD2 - MS5 C18 H22 N2 O5 S COc1cccc(c....
107 1CRA - TRI C2 H3 N3 c1[nH]cnn1
108 4KNJ Kd = 11.1 nM E1F C12 H10 Cl N3 O3 S2 c1cnc(nc1)....
109 1OKM - SAB C11 H17 N3 O3 S c1cc(ccc1C....
110 3RZ5 Kd = 13 nM RZ5 C12 H18 N2 O3 S CCCCCNC(=O....
111 4Q7S Ki = 38 uM 2YU C6 H7 N O S CC1=CC(=S)....
112 3N4B Ki = 96 nM WWZ C13 H12 F N3 O3 S c1cc(ccc1N....
113 3M1K Ki = 4.1 uM BEW C5 H6 N O S c1cc[n+](c....
114 1CIM Ki = 1.52 nM PTS C8 H12 N2 O4 S3 C[C@H]1C[C....
115 4MLT Ki = 1.4 mM TM4 C6 H6 O2 S CC1=C(C(=S....
116 3HKN Ki = 4.51 uM MFS C26 H37 N O19 S CC(=O)OC[C....
117 4RFD Ki = 8.9 nM 3O5 C10 H16 N2 O3 S c1cc(ccc1O....
118 2GEH Ki = 28 uM NHY C H4 N2 O2 C(=O)(N)NO
119 4ZX1 - 5L3 C13 H24 N2 O11 S2 CC(=O)O[C@....
120 4E49 Ki = 7.7 uM RCO C6 H6 O2 c1cc(cc(c1....
121 3M3X Kd = 0.15 uM JS7 C13 H15 N5 O5 S COc1c(c(nc....
122 3B4F Ki = 7.2 nM TUO C15 H14 N4 O3 S c1ccc(cc1)....
123 5SZ0 Ki = 0.8 nM 72D C12 H11 N O2 S c1ccc(cc1)....
124 4E3G Ki = 8 mM PHB C7 H6 O3 c1cc(ccc1C....
125 4M2U Ki = 9.1 nM ETS C10 H16 N2 O4 S3 CCN[C@H]1C....
126 4MDL Ki = 1.16 uM 25Y C3 H5 B10 N2 O2 S B1234B567B....
127 4R5B Ki = 185 nM 3J4 C10 H20 N2 O10 S2 C1CN(C[C@@....
128 4Q99 Ki = 52 uM HT4 C7 H8 O S Cc1ccc(c(c....
129 5N0E Ki = 3.6 nM 8F3 C22 H20 N2 O5 S c1ccc(cc1)....
130 4Z1E Ki = 5.7 nM DF5 C17 H15 N2 O4 S COc1ccc2c(....
131 1BNQ Kd = 0.32 nM AL4 C11 H19 N3 O5 S3 CCN[C@H]1C....
132 1XPZ Kd = 84 nM 4TZ C16 H14 N6 O3 S c1cc(ccc1C....
133 4Z1N Ki = 5.89 nM 4KD C18 H20 N2 O5 S COc1cc2c(c....
134 2NNV Kd = 0.03 uM M29 C11 H15 N O4 S CCOC(=O)CC....
135 4Q8X Ki = 270 uM 7FH C6 H4 F3 N O S C1=CC(=S)N....
136 4KV0 Ki = 12 nM MB7 C13 H14 N4 O5 S2 Cc1ccc(cc1....
137 1G1D Kd = 0.36 nM FSB C14 H13 F N2 O3 S c1ccc(c(c1....
138 4R5A Ki = 2 nM 3J4 C10 H20 N2 O10 S2 C1CN(C[C@@....
139 5SZ7 - 72H C15 H12 N2 O2 S c1ccc2c(c1....
140 4PZH Kd < 10 nM V13 C8 H7 F4 N O5 S2 C(CS(=O)(=....
141 4Q07 Kd < 5 nM V14 C16 H23 F3 N2 O5 S2 C1CCCC(CCC....
142 3N3J Ki = 3.3 nM WWV C16 H19 N3 O3 S CC(C)c1ccc....
143 3CAJ Ki = 8 nM EZL C9 H10 N2 O3 S2 CCOc1ccc2c....
144 5DOH Kd = 32 nM 5DU C17 H17 F3 N2 O3 S2 c1ccc2c(c1....
145 5TI0 Ki = 61 uM 7CZ C7 H6 O S C1=CC=C(C(....
146 4RIU - 3QR C16 H18 N4 O9 S c1cc2c(cc1....
147 3NI5 Ki = 28 nM C1H C13 H15 N5 O9 S3 c1cc(cc(c1....
148 3SBH Kd = 0.033 uM E65 C14 H15 N3 O3 S2 Cc1cc(nc(n....
149 4QY3 Ki = 0.15 uM 3G1 C14 H12 O3 S c1ccc(cc1)....
150 3D9Z Ki = 2 nM D9Z C8 H6 Cl N3 O2 S2 c1ccc(c(c1....
151 4HEZ - 1MZ C4 H7 N2 Cn1cc[nH+]....
152 1G52 Kd = 0.29 nM F2B C14 H12 F2 N2 O3 S c1cc(c(c(c....
153 5TY8 Kd = 3.5 uM 7Q1 C9 H7 N O3 c1ccc(cc1)....
154 4Q87 Ki = 14 uM 4FH C6 H4 F3 N O S C1=CN(C(=S....
155 1I9O Kd = 3.8 nM IOC C14 H11 F3 N2 O3 S c1cc(ccc1C....
156 5FLQ Kd = 1080 uM IO2 C15 H14 O3 c1ccc(cc1)....
157 1YDD Kd = 86 nM AZM C4 H6 N4 O3 S2 CC(=O)Nc1n....
158 2POV Ki = 75 nM I7B C6 H8 Cl N3 O4 S2 c1c(c(cc(c....
159 1G4J Kd = 2 nM FFB C14 H9 F5 N2 O3 S c1cc(ccc1C....
160 3D8W Ki = 7 nM D8W C8 H8 N4 O4 S3 c1ccc(cc1)....
161 5FNH - YIP C8 H6 Cl N4 O c1cc(cc(c1....
162 2WEH Kd = 1125 nM FB1 C6 H6 Cl N O2 S c1ccc(c(c1....
163 3M67 Kd = 0.18 uM E36 C17 H14 Cl N3 O5 S2 c1cc(c(cc1....
164 1I9M Kd = 3.3 nM INW C14 H12 F2 N2 O3 S c1cc(ccc1C....
165 5JE7 - EVF C7 H6 N2 O2 S2 c1ccc2c(c1....
166 2X7S Ki = 1660 nM WZC C19 H27 N O5 S C[C@]12CC[....
167 5BRU - 8TH C30 H35 Cl Ir N3 O4 S2 CCCC12C3([....
168 2FMG - PHE C9 H11 N O2 c1ccc(cc1)....
169 1TTM Kd ~ 45 nM 667 C14 H15 N O5 S c1cc2c(cc1....
170 3MHM Kd = 0.1 uM J75 C18 H18 N6 O4 S c1ccc(cc1)....
171 2POW Ki = 63 nM I7C C7 H8 F3 N3 O4 S2 c1c(c(cc(c....
172 5TXY Kd = 3.5 uM 7Q1 C9 H7 N O3 c1ccc(cc1)....
173 1AVN Kd = 0.125 mM HSM C5 H9 N3 c1c(nc[nH]....
174 5EHW Kd = 1005 uM 5OO C9 H6 Cl2 O2 c1cc(c(cc1....
175 1LUG - SUA C13 H14 N2 O3 S3 c1cc(ccc1N....
176 5LJQ Ki = 1 nM ANV C15 H16 N4 O3 S c1ccc(cc1)....
177 4E4A Ki = 9 mM JKE C7 H6 O2 S c1ccc(c(c1....
178 1ZE8 Ki = 21 nM PIU C16 H21 N2 O2 S Cc1cc([n+]....
179 1BNN Kd = 0.1 nM AL1 C13 H14 N2 O5 S3 COc1cccc(c....
180 4RUX Ki = 12 nM 3W3 C9 H11 N O3 S C=CCOc1ccc....
181 5BNL - 2HC C9 H8 O3 c1ccc(c(c1....
182 1XQ0 Kd = 454 nM 4TR C16 H13 Br N6 O3 S c1cc(ccc1C....
183 2Q1B Ki = 5950 nM LSA C7 H5 N O3 S c1ccc2c(c1....
184 4Q8Y Ki = 2300 uM HQT C9 H7 N O S c1ccc2c(c1....
185 5THN Ki = 96 uM 7CZ C7 H6 O S C1=CC=C(C(....
186 4YXO Kd = 125.4 nM 4JC C8 H11 N O2 S CCc1ccc(cc....
187 5DOG - 5DT C21 H19 F3 N2 O2 S2 c1ccc(cc1)....
188 3BET ic50 = 1.5 uM CTF C21 H28 N2 O4 S C[C@]12CC[....
189 4R59 Ki = 11 nM 3J3 C11 H22 N2 O10 S2 C1CN(CCC1O....
190 5DRS Kd = 1.1 nM 5EF C17 H17 F3 N2 O5 S2 c1ccc2c(c1....
191 5FDC Ki = 34.8 nM 5WN C9 H10 N2 O2 S2 c1ccc2c(c1....
192 1YDA Kd = 280 nM AZM C4 H6 N4 O3 S2 CC(=O)Nc1n....
193 1CNX Kd = 43 nM EG2 C13 H21 N3 O5 S c1cc(ccc1C....
194 5LMD - RC4 C16 H18 B N2 O5 [B-]1(c2cc....
195 4BCW - TU0 C8 H7 Br O4 S c1cc(c(cc1....
196 5AML Ki = 0.7 nM 51J C11 H12 N2 O6 S2 CC#CCNS(=O....
197 4Q7V Ki = 260 uM 5MH C6 H7 N O S CC1=CN(C(=....
198 3RYX Kd = 7.3 nM RYX C10 H9 F5 N2 O3 S c1cc(ccc1C....
199 5EH5 Kd = 1.35 uM XCZ C5 H7 N3 O2 S Cc1ccnc(n1....
200 1IF9 - SBB C19 H21 N3 O3 S CC[C@H](CN....
201 5FNI Kd = 330 uM YIH C8 H5 Cl2 N4 O c1cc(c(cc1....
202 4RN4 Ki = 114 nM 3T7 C20 H24 N10 O7 S2 c1ccc(cc1)....
203 2H15 Ki = 2135 nM B19 C12 H22 N2 O7 S CC1(O[C@@H....
204 4Q8Z - 4HO C6 H7 N O2 CC1=CC(=O)....
205 3T82 Ki = 307 nM SG4 C10 H17 N O10 S CC(=O)O[C@....
206 1KWR ic50 = 0.25 uM SG2 C8 H8 N2 O3 S2 CN1c2ccc(c....
207 5THI Ki = 245 uM 0TR C7 H6 O2 C1=CC=C(C(....
208 1OQ5 ic50 = 21 nM CEL C17 H14 F3 N3 O2 S Cc1ccc(cc1....
209 2HL4 Ki = 23 nM BO1 C12 H18 N2 O7 S c1cc(ccc1N....
210 2OSM ic50 = 1.05 uM HTS C6 H6 O S c1ccc(c(c1....
211 3P58 Ki = 25.4 nM P58 C9 H11 N S2 CN(Cc1cccc....
212 1G53 Kd = 0.91 nM F6B C14 H12 F2 N2 O3 S c1cc(c(c(c....
213 4MTY - SBW C14 H14 N2 O4 S c1cc(cc(c1....
214 3BL0 Ki = 121 nM BL0 C5 H10 N4 O2 S2 CN(C)c1nnc....
215 2QOA Ki = 52 nM MAJ C9 H11 N O2 S c1cc2c(cc1....
216 3SAX Kd = 0.14 uM E50 C14 H14 Cl N3 O3 S2 CCc1cnc(nc....
217 4HEY - 4MZ C4 H6 N2 Cc1c[nH]cn....
218 1BCD Kd = 2 nM FMS C H2 F3 N O2 S C(F)(F)(F)....
219 5E2R Ki = 86.2 nM 520 C19 H16 N2 O3 S c1cc(ccc1c....
220 3RZ7 Kd = 1.1 nM RZ7 C13 H9 F11 N2 O3 S c1cc(ccc1C....
221 3MHL Kd = 0.056 uM J71 C12 H13 N5 O5 S COc1c(c(nc....
222 2FNN Ki = 200 mM 4MZ C4 H6 N2 Cc1c[nH]cn....
223 3P5L Ki = 40.8 nM IT5 C13 H14 N2 S2 c1ccc(cc1)....
224 5E2S Ki = 0.98 nM 5CX C15 H17 N O2 S CC(C)c1ccc....
225 4Q08 Kd = 500 nM V90 C16 H23 F3 N2 O3 S2 C1CCCC(CCC....
226 2WD3 ic50 = 86 nM MS4 C16 H12 Cl N5 O3 S c1cc(c(cc1....
227 2POU Ki = 38 nM I7A C6 H6 Cl2 N2 O4 S2 c1c(cc(c(c....
228 4E3F Ki = 3 mM GRE C7 H6 O4 c1cc(c(c(c....
229 3NB5 Ki = 18 nM R21 C16 H17 Cl N2 O4 S c1cc(ccc1C....
230 5AMG Ki = 6 nM IW7 C12 H18 N2 O6 S2 CCCCCNS(=O....
231 2HOC Ki = 0.3 nM 1CN C8 H7 Cl F N5 O4 S3 c1c(cc(c(c....
232 1I9N Kd = 2.2 nM IOA C14 H12 F2 N2 O3 S c1cc(ccc1C....
233 3DD8 Ki = 14 nM 2C7 C16 H21 N O5 S2 c1cc2c(cc1....
234 4Q9Y Ki = 2.1 uM M3T C7 H8 S Cc1cccc(c1....
235 5FLP Kd = 631 uM 6J5 C8 H7 Cl N4 O c1ccc(c(c1....
236 2WEG Kd = 314 nM FBV C6 H6 F N O2 S c1ccc(c(c1....
237 3RZ0 Kd = 28 nM RZ0 C11 H16 N2 O3 S CCCCNC(=O)....
238 4ZWY Ki = 10 nM 4SN C19 H32 N2 O14 S2 CC(=O)OC[C....
239 1CNY Kd = 14 nM EG3 C22 H30 N4 O6 S c1ccc(cc1)....
240 3MMF Ki = 37 nM D9H C11 H13 Cl N6 O3 S c1cc(ccc1N....
241 5TFX Ki = 60.9 nM 7B1 C14 H11 N3 O4 S c1ccc(cc1)....
242 4WW6 Kd = 0.062 nM 3TV C9 H9 F4 N O2 S2 CCCSc1c(c(....
243 3SAP Kd = 0.014 uM E2I C16 H19 N3 O3 S2 CCCCc1cnc(....
244 2FOV Kd = 28 nM B30 C13 H15 Cu N3 O7 S c1cc(ccc1C....
245 2X7U Ki = 5340 nM WZA C19 H27 N O5 S C[C@]12CC[....
246 5JEG - EVF C7 H6 N2 O2 S2 c1ccc2c(c1....
247 2NNS Kd = 0.9 uM M25 C10 H14 N2 O3 S CC(=O)NCCc....
248 4Q6E Kd = 0.667 uM KR5 C14 H18 N4 O3 S Cc1cc(n(n1....
249 4JSZ Ki = 5000 uM FB2 C6 H7 N O2 S c1ccc(cc1)....
250 5FDI Ki = 18.5 nM 5WM C9 H10 N2 O4 S2 c1ccc2c(c1....
251 5GMN Kd = 18.8 uM 949 C18 H16 F N O4 S CC1(C(=O)C....
252 3FFP Ki = 72.5 nM LC1 C10 H8 N4 O2 S2 c1cc2c(cc1....
253 3R17 Ki = 390 nM 5UM C12 H11 F N2 O3 S2 c1cc(sc1)C....
254 5SZ2 Ki = 2 nM 72G C13 H11 N O3 S c1cc(cc(c1....
255 2HD6 Ki = 16 nM BOS C13 H12 N2 O3 S2 c1ccc(c(c1....
256 2QO8 Ki = 3.4 nM 3CC C17 H26 N2 O3 S CCCC(CCC)C....
257 5FNJ Kd = 5150 uM YI6 C10 H12 O3 CCOc1ccc(c....
258 1I91 ic50 = 1.15 nM INQ C17 H19 N3 O6 S3 c1cc(cc(c1....
259 4YXI Kd = 331.7 nM 4J8 C7 H9 N O2 S Cc1ccc(cc1....
260 1BN1 Kd = 0.46 nM AL5 C12 H14 N2 O4 S3 Cc1ccc(cc1....
261 5JQT Ki = 8180 nM 6M9 C7 H7 B O2 B1(c2ccccc....
262 1G48 Kd = 3.9 nM F6B C14 H12 F2 N2 O3 S c1cc(c(c(c....
263 5SZ4 - 72D C12 H11 N O2 S c1ccc(cc1)....
264 1AM6 ic50 = 47 uM HAE C2 H5 N O2 CC(=O)NO
265 1OKL Kd = 0.93 uM MNS C12 H14 N2 O2 S CN(C)c1ccc....
266 3OY0 Ki = 10.1 nM OY0 C15 H24 N2 O3 S CCC[C@H](C....
267 2FOS Kd = 27 nM B17 C17 H23 Cu N3 O9 S c1cc(ccc1C....
268 2EZ7 Kd = 43.5 uM DHI C6 H10 N3 O2 c1c([nH+]c....
269 3MZC Ki = 226 nM S6I C12 H17 N3 O3 S c1cc(ccc1N....
270 5A6H Ki = 88 nM OE2 C11 H14 Br N3 O5 S c1cc(c(cc1....
271 1IF7 Kd = 30 pM SBR C19 H21 N3 O3 S C[C@H](CNC....
272 3DCW Ki < 1 nM EZL C9 H10 N2 O3 S2 CCOc1ccc2c....
273 5JGS - EVF C7 H6 N2 O2 S2 c1ccc2c(c1....
274 3C7P ic50 = 0.1 nM POF C24 H27 N3 O5 S C[C@]12CC[....
275 5O07 Ki = 33.8 nM 1VQ C6 H10 N4 O5 S Cc1ncc(n1C....
276 5TH4 - BEW C5 H6 N O S c1cc[n+](c....
277 3DAZ Ki = 11.8 nM MZM C5 H8 N4 O3 S2 CC(=O)/N=C....
278 4PQ7 Ki = 9.5 nM IL3 C11 H14 N2 O3 S CC#CCOc1cc....
279 5L3O - QUJ QUK 6H0 QVS QVE n/a n/a
280 1G54 Kd = 1.5 nM FFB C14 H9 F5 N2 O3 S c1cc(ccc1C....
281 4Z1K Ki = 4.7 nM 4KB C16 H16 N2 O5 S c1cc(ccc1C....
282 4JSS Ki = 500 uM BEW C5 H6 N O S c1cc[n+](c....
283 2Q38 Ki = 5950 nM LSA C7 H5 N O3 S c1ccc2c(c1....
284 3HS4 Ki = 10 nM AZM C4 H6 N4 O3 S2 CC(=O)Nc1n....
285 4BF6 Ki = 4.5 nM X0Q C13 H9 N5 O2 S2 c1cc(cc(c1....
286 2HKK Ka = 96 M^-1 ALE C9 H13 N O3 CNC[C@@H](....
287 2NNG Kd = 4.4 uM ZYX C8 H12 N2 O2 S c1cc(ccc1C....
288 3F8E Ki = 59 nM TE1 C15 H20 O5 CC(C)C[C@@....
289 5FLO Kd = 709 uM J4K C8 H7 Cl N4 O c1cc(ccc1O....
290 3DD0 Ki < 1 nM EZL C9 H10 N2 O3 S2 CCOc1ccc2c....
291 3ML2 Ki = 9.1 nM SU0 C18 H16 N2 O6 S COc1ccc2c(....
292 4M2R Ki = 3.2 nM BZ1 C12 H21 N3 O5 S3 CCN[C@H]1C....
293 4JSA Ki = 11 uM FB2 C6 H7 N O2 S c1ccc(cc1)....
294 3CYU Kd = 60 nM 0CR C74 H74 N10 O18 S COc1cc2c3c....
295 1IF4 - FBS C6 H6 F N O2 S c1cc(ccc1F....
296 1BNW Kd = 0.83 nM TPD C9 H10 N2 O4 S4 c1cc(sc1)C....
297 2EU3 - FF3 C3 H4 F2 N4 O2 S2 c1(nnc(s1)....
298 2QP6 Ki = 58.9 nM MB1 C6 H5 Cl N2 O4 S c1cc(c(cc1....
299 5JES - EVF C7 H6 N2 O2 S2 c1ccc2c(c1....
300 5JDV - EVF C7 H6 N2 O2 S2 c1ccc2c(c1....
301 4MDM Ki = 6.79 uM 26E C3 H5 B9 N2 O2 S B123B45B16....
302 3RZ8 Kd = 6.7 nM RZ8 C13 H20 N2 O3 S CCCCCCNC(=....
303 3EFT Ki = 12 nM 3BS C16 H25 Cl N4 O3 S2 CC1(CC(CC(....
304 5U0D Kd = 28.6 uM 7R7 C11 H11 N O4 S COc1ccc(c(....
305 1CIN Ki = 1.88 nM MTS C9 H14 N2 O4 S3 C[C@H]1C[C....
306 4MLX Kd = 0.65 mM TM7 C6 H6 O2 S CC1=CC(=S)....
307 2FMZ Ki = 35 nM DPN C9 H11 N O2 c1ccc(cc1)....
308 5SZ6 - 72G C13 H11 N O3 S c1cc(cc(c1....
309 3IEO Ki = 331 nM AMJ C13 H18 N2 O3 CC(=O)N[C@....
310 3F4X Ki = 138 nM KLT C14 H11 Cl N2 O4 S c1ccc2c(c1....
311 3T5U Ki = 5.47 uM A09 C6 H7 N O3 S c1ccc(cc1)....
312 1BNU Kd = 0.2 nM AL3 C11 H12 N2 O5 S4 c1cc(sc1)C....
313 1OKN Kd = 2.3 nM STB C12 H19 N3 O3 S2 c1cc(ccc1C....
314 3DBU Ki = 8.8 nM D8W C8 H8 N4 O4 S3 c1ccc(cc1)....
315 4MO8 Ki = 10.1 nM 2VQ C6 H11 N5 O4 S Cc1ncc(n1C....
316 1I9P Kd = 3.9 nM IOE C14 H11 F3 N2 O3 S c1cc(ccc1C....
317 3N2P Ki = 15 nM AYX C13 H12 N4 O5 S c1cc(cc(c1....
318 4QJM Kd = 6.7 nM V1F C21 H19 F3 N2 O4 S2 c1ccc(cc1)....
319 3M40 Kd = 0.17 uM J45 C10 H8 Cl N5 O4 S c1cc(ccc1N....
320 5TY9 Kd = 6.1 uM 7QV C11 H11 N O5 COc1ccc(c(....
321 2FOU Kd = 80 nM B22 C21 H22 Cu N4 O8 S c1cc(cc(c1....
322 4QSA Kd = 40 nM EWW C13 H12 Cl N3 O4 S2 CC1=CC(=O)....
323 5FNG Kd = 1105 uM YIE C8 H6 Cl N4 c1cc(ccc1C....
324 4BF1 Ki = 2.4 nM 9FK C16 H12 N4 O2 S2 c1ccc2c(c1....
325 4ZWI - 62I C13 H24 N2 O11 S2 CC(=O)OC[C....
326 1BN3 Kd = 0.13 nM AL6 C13 H12 N2 O5 S3 COc1cccc(c....
327 4Q90 Ki = 7 mM 4H2 C6 H7 N S CC1=CC(=S)....
328 5EHV Kd = 826 uM 5ON C18 H16 O5 c1cc(cc(c1....
329 4MDG Ki = 0.7 uM 25X C3 H5 B10 N2 O2 S B1234B567B....
330 5JQ0 - 6M4 C7 H8 B O3 [B+]1(c2cc....
331 3MNU Ki = 48 nM BON C12 H19 B N2 O4 S B1(OC(C(O1....
332 2ABE Ki = 113 uM HIS C6 H10 N3 O2 c1c([nH+]c....
333 4HEW - 2MZ C4 H6 N2 Cc1[nH]ccn....
334 5G01 - OE2 C11 H14 Br N3 O5 S c1cc(c(cc1....
335 3RYY Kd = 38 nM RYY C10 H14 N2 O3 S CCCNC(=O)c....
336 3SBI Kd = 0.017 uM E90 C12 H11 N3 O3 S2 c1cnc(nc1)....
337 5FNL Kd = 826 uM 5ON C18 H16 O5 c1cc(cc(c1....
338 3RZ1 Kd = 1.8 nM RZ1 C12 H9 F9 N2 O3 S c1cc(ccc1C....
339 4QSB Kd = 1300 nM EWY C13 H13 N3 O4 S2 CC1=CC(=O)....
340 1YDB Kd = 5.8 nM AZM C4 H6 N4 O3 S2 CC(=O)Nc1n....
341 5EKJ Kd = 1 uM TG4 C14 H23 N3 O3 S CCCCNCC(=O....
342 4Q7W Ki = 2300 uM 6MH C6 H7 N O S CC1=CC=CC(....
343 2EU2 - 5DS C5 H11 N5 O2 S2 CN(C)c1nnc....
344 4CQ0 - SXS C7 H6 N2 O3 S c1cc2c(cc1....
345 1MOO - 4MZ C4 H6 N2 Cc1c[nH]cn....
346 3DC3 Ki = 4.9 nM AZM C4 H6 N4 O3 S2 CC(=O)Nc1n....
347 3MNA Ki = 41 nM DWH C12 H13 Cl N6 O4 S COC(=O)CNc....
348 1CNW Kd = 19 nM EG1 C15 H24 N4 O6 S c1cc(ccc1C....
349 4Z0Q Ki = 6.8 nM 4K9 C16 H16 N2 O3 S c1ccc2c(c1....
350 4LP6 - Q4I C68 H64 N12 O16 S CC(C)COc1c....
351 5THJ Ki = 1350 uM 0TR C7 H6 O2 C1=CC=C(C(....
352 2HNC Ki = 60 nM 1SA C2 H4 N4 O2 S2 c1(nnc(s1)....
353 3S9T Kd = 0.22 uM E49 C14 H14 Cl N3 O3 S2 Cc1cc(nc(n....
354 4ILX Ki = 233 nM 1EZ C18 H24 N2 O3 S c1cc(ccc1N....
355 5AMD Ki = 2.8 nM 45I C15 H16 N2 O6 S2 c1ccc(cc1)....
356 3P4V Ki = 8 uM PMX C14 H14 Cl N O6 COC(=O)/C=....
357 3IBI Ki = 2.6 nM BOW C8 H19 N O3 S CCCCCCCCOS....
358 5JEH - EVF C7 H6 N2 O2 S2 c1ccc2c(c1....
359 2H4N Ki = 2 nM AZM C4 H6 N4 O3 S2 CC(=O)Nc1n....
360 5FNM Kd = 791 uM 5O6 C11 H12 O3 C/C(=CC(=O....
361 1ZSB Kd = 250 mM AZM C4 H6 N4 O3 S2 CC(=O)Nc1n....
362 3OYQ Ki = 10.3 nM OYQ C13 H20 N2 O3 S CC[C@H](C)....
363 3T85 Ki = 11.3 nM SG7 C10 H17 N O10 S CC(=O)O[C@....
364 1IF5 - FBT C6 H5 F2 N O2 S c1cc(c(c(c....
365 3IBN Ki = 24.5 nM O60 C10 H24 N2 O6 S2 C(CCCCCOS(....
366 4KAP - 1QV C7 H2 F4 N2 O2 S2 c12c(c(c(c....
367 5E28 Ki = 12.3 nM BC5 C12 H12 N2 O2 S c1cc(ccc1c....
368 5LVS - QUJ QUK 6H0 QVS QVE n/a n/a
369 5SZ1 Ki = 1.2 nM 72E C13 H13 N O2 S Cc1ccccc1c....
370 1I90 ic50 = 1.28 nM INM C10 H15 N3 O5 S3 COCCC[N@]1....
371 4IWZ Ki = 51 nM 1GO C8 H8 N4 O3 S3 c1cc(sc1)C....
372 4E3H Ki = 90 nM HQE C6 H6 O2 c1cc(ccc1O....
373 1I8Z ic50 = 1.27 nM INL C18 H21 N3 O6 S3 COc1cccc(c....
374 2F14 Ki = 45 nM FL1 C29 H23 N3 O7 S2 c1cc(ccc1C....
375 3R16 Ki = 50 nM 5UN C12 H12 N2 O3 S2 c1cc(sc1)C....
376 1CIL Ki = 0.372 nM ETS C10 H16 N2 O4 S3 CCN[C@H]1C....
377 4ZX0 - 5L2 C14 H24 N2 O13 S2 CC(=O)OC[C....
378 3MHI Kd = 0.2 uM J90 C11 H11 N5 O5 S c1cc(ccc1C....
379 3DCC Ki = 1.1 nM D9Z C8 H6 Cl N3 O2 S2 c1ccc(c(c1....
380 4KNI Kd = 16.7 nM E1E C14 H14 Cl N3 O3 S2 Cc1cc(nc(n....
381 3IGP ic50 = 94.5 nM DT7 C11 H16 N2 O4 S COc1cc2c(c....
382 3RYJ Kd = 16 nM RYJ C9 H9 F3 N2 O3 S c1cc(ccc1C....
383 2FOQ Kd = 235 nM B15 C20 H21 Cu N3 O7 S c1cc(ccc1C....
384 4ZWX Ki = 2 nM 5KZ C19 H32 N2 O14 S2 CC(=O)OC[C....
385 5N0D Ki = 3.3 nM 8F2 C22 H20 N2 O5 S c1ccc(cc1)....
386 4Q83 Ki = 64 uM 3FH C6 H4 F3 N O S C1=CN(C(=S....
387 4QJX Kd = 52 nM WWO C15 H15 F3 N2 O5 S2 c1ccc(cc1)....
388 4HU1 Kd = 29 nM V13 C8 H7 F4 N O5 S2 C(CS(=O)(=....
389 4KNN Kd = 16.7 nM E1F C12 H10 Cl N3 O3 S2 c1cnc(nc1)....
390 4KNM Kd = 10 nM E1E C14 H14 Cl N3 O3 S2 Cc1cc(nc(n....
391 4QIZ Kd = 7.1 nM WWX C22 H21 F3 N2 O6 S2 c1ccc(cc1)....
392 5E2N Kd = 0.29 nM V14 C16 H23 F3 N2 O5 S2 C1CCCC(CCC....
393 3CZV Ki = 16 nM AZM C4 H6 N4 O3 S2 CC(=O)Nc1n....
394 4QJP Kd = 2.5 nM V1F C21 H19 F3 N2 O4 S2 c1ccc(cc1)....
395 4QSJ Kd = 5 nM EWW C13 H12 Cl N3 O4 S2 CC1=CC(=O)....
396 4COQ - SAN C6 H8 N2 O2 S c1cc(ccc1N....
397 4UOV - AZM C4 H6 N4 O3 S2 CC(=O)Nc1n....
398 5TT3 Ki = 193 nM EZL C9 H10 N2 O3 S2 CCOc1ccc2c....
399 5TUO Ki = 323 nM 1SA C2 H4 N4 O2 S2 c1(nnc(s1)....
400 4X5S - AZM C4 H6 N4 O3 S2 CC(=O)Nc1n....
401 4QJ0 Kd = 48 nM WWX C22 H21 F3 N2 O6 S2 c1ccc(cc1)....
402 4QJO Kd = 40 nM V1F C21 H19 F3 N2 O4 S2 c1ccc(cc1)....
403 4KP8 Kd = 3330 nM E1G C12 H11 N3 O3 S2 c1cc(cc(c1....
404 4KP5 Kd = 833 nM E1F C12 H10 Cl N3 O3 S2 c1cnc(nc1)....
405 1JD0 - AZM C4 H6 N4 O3 S2 CC(=O)Nc1n....
406 4QJW Kd = 16 nM WWO C15 H15 F3 N2 O5 S2 c1ccc(cc1)....
407 4HT2 Kd = 290 nM V50 C12 H9 F4 N3 O2 S2 Cc1cc(nc(n....
408 4WW8 Kd = 0.067 nM VD9 C9 H13 N O2 S2 CCCSc1ccc(....
409 4Q0L Kd < 10 nM V14 C16 H23 F3 N2 O5 S2 C1CCCC(CCC....
410 1FLJ - GSH C10 H17 N3 O6 S C(CC(=O)N[....
411 5FL6 Ki = 43.6 nM Y0R C13 H12 N4 O2 S2 Cc1ccc(cc1....
412 5FL4 Ki = 101 nM 9FK C16 H12 N4 O2 S2 c1ccc2c(c1....
413 3IAI - AZM C4 H6 N4 O3 S2 CC(=O)Nc1n....
414 5FL5 Ki = 6.4 nM 82E C13 H12 N4 O3 S2 COc1ccc(cc....
415 1DMY - AZM C4 H6 N4 O3 S2 CC(=O)Nc1n....
416 3ML5 - AZM C4 H6 N4 O3 S2 CC(=O)Nc1n....
417 2NMX Kd = 2.7 uM M25 C10 H14 N2 O3 S CC(=O)NCCc....
418 1BZM - MZM C5 H8 N4 O3 S2 CC(=O)/N=C....
419 2FW4 Kd = 30 nM HIS C6 H10 N3 O2 c1c([nH+]c....
420 3LXE Ki = 250 nM TOR C12 H21 N O8 S CC1(O[C@@H....
421 2IT4 Ki = 24.1 mM PPF C H3 O5 P C(=O)(O)P(....
422 2NN7 Kd = 0.3 uM M29 C11 H15 N O4 S CCOC(=O)CC....
423 5E2M Kd = 59 nM V14 C16 H23 F3 N2 O5 S2 C1CCCC(CCC....
424 4WR7 Kd = 0.002 uM 3TV C9 H9 F4 N O2 S2 CCCSc1c(c(....
425 4WUQ - 3UG C11 H12 F4 N2 O2 S C1CCN(CC1)....
426 1CZM - AAS C8 H10 Hg N2 O4 S CC(=O)O[Hg....
427 2NN1 Kd = 1.5 uM M28 C9 H11 N O4 S c1cc(ccc1C....
428 4WUP Kd = 0.15 nM 3UF C8 H11 N O3 S2 c1cc(ccc1S....
429 2FOY Kd = 120 nM B30 C13 H15 Cu N3 O7 S c1cc(ccc1C....
430 5GMM Kd = 29.1 uM 949 C18 H16 F N O4 S CC1(C(=O)C....
431 1AZM - AZM C4 H6 N4 O3 S2 CC(=O)Nc1n....
432 3F7B ic50 = 64 nM AG5 C20 H19 N3 O3 S2 c1ccc(cc1)....
433 4LU3 - AZM C4 H6 N4 O3 S2 CC(=O)Nc1n....
434 5CJF Ki = 0.26 nM 520 C19 H16 N2 O3 S c1cc(ccc1c....
435 4G7A - AZM C4 H6 N4 O3 S2 CC(=O)Nc1n....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: SAN; Similar ligands found: 12
No: Ligand ECFP6 Tc MDL keys Tc
1 SAN 1 1
2 BC5 0.642857 0.930233
3 4WA 0.5625 0.909091
4 M4S 0.482759 0.729167
5 FBS 0.464286 0.795455
6 4J8 0.464286 0.853659
7 520 0.461538 0.869565
8 FB2 0.423077 0.875
9 4JC 0.419355 0.813953
10 3W8 0.411765 0.686275
11 ZYX 0.40625 0.808511
12 0F3 0.40625 0.909091
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 4COQ; Ligand: SAN; Similar sites found: 1177
This union binding pocket(no: 1) in the query (biounit: 4coq.bio1) has 12 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 3SAO NKN 0.003891 0.43509 None
2 3UC5 ATP 0.04741 0.4165 None
3 1LNX URI 0.004486 0.41039 None
4 3CI3 5AD 0.03195 0.40198 None
5 3CI3 3PO 0.03195 0.40198 None
6 4F4S EFO 0.007162 0.40183 None
7 4LBP 1WG 0.03297 0.40134 None
8 2NX1 PEP 0.0003242 0.49314 0.809717
9 2NX1 RP5 0.0011 0.46862 0.809717
10 1GEX PLP HSA 0.006351 0.43053 0.809717
11 1QRD FAD 0.009436 0.4196 0.809717
12 3SVL FMN 0.001134 0.45142 1.21457
13 3P9C SAH 0.004756 0.44453 1.21457
14 3L0E G58 0.00713 0.42968 1.21457
15 1YOA FAD 0.0003422 0.48304 1.25786
16 3ZLM ANP 0.0009885 0.45625 1.59574
17 2H8Z 8CM 0.002817 0.45119 1.61943
18 2H8Z FMN 0.002817 0.45119 1.61943
19 4MOB COA 0.005318 0.44906 1.61943
20 3ZS7 ATP 0.003817 0.43577 1.61943
21 1T8U UAP SGN IDS SGN 0.01655 0.42533 1.61943
22 4MOB ADP 0.005555 0.41996 1.61943
23 4HZO COA 0.003464 0.41511 1.61943
24 1T8U A3P 0.009285 0.41488 1.61943
25 1ML4 PAL 0.01072 0.41297 1.61943
26 3GB5 FMN 0.0171 0.40298 1.61943
27 1H9G COA MYR 0.001453 0.4615 1.64609
28 3QP4 HL0 0.001328 0.44613 1.64835
29 1Q3P GLU ALA GLN THR ARG LEU 0.001652 0.44199 1.83486
30 2Y7P SAL 0.006014 0.42215 1.83486
31 4B63 ORN 0.0053 0.4936 2.02429
32 4B63 FAD 0.0053 0.4936 2.02429
33 4B63 NAP 0.005459 0.4936 2.02429
34 1MOQ GLP 0.0002158 0.48555 2.02429
35 1XLI GLT 0.0007461 0.48369 2.02429
36 2GDZ NAD 0.0007314 0.47987 2.02429
37 4LSJ LSJ 0.0003682 0.47958 2.02429
38 3TXO 07U 0.000229 0.47691 2.02429
39 3UR0 SVR 0.003409 0.46433 2.02429
40 4OE4 NAD 0.001678 0.46376 2.02429
41 3VPD ANP 0.00099 0.46031 2.02429
42 1CBF SAH 0.001023 0.45109 2.02429
43 2PWY SAH 0.002103 0.44922 2.02429
44 1SNY NAP 0.003028 0.44682 2.02429
45 1SZD APR 0.005277 0.44596 2.02429
46 1P9P SAH 0.002271 0.44595 2.02429
47 2GYI HYA 0.01477 0.44543 2.02429
48 2P2V CSF 0.01297 0.44003 2.02429
49 3WQM B29 0.004079 0.43779 2.02429
50 3WO0 ADP 0.008473 0.43726 2.02429
51 3WO0 ALA 0.008473 0.43726 2.02429
52 2QQF A1R 0.004628 0.43684 2.02429
53 4HZD COA 0.01113 0.43052 2.02429
54 3ZF8 GDP 0.002102 0.42999 2.02429
55 1H65 GDP 0.005498 0.42688 2.02429
56 4A8H PUW 0.01175 0.42423 2.02429
57 2QCX PF1 0.001986 0.42207 2.02429
58 3I51 6PL 0.009736 0.422 2.02429
59 2OD9 A1R NCA 0.01299 0.42156 2.02429
60 1TO9 HMH 0.002 0.41847 2.02429
61 1NHZ 486 0.009513 0.41783 2.02429
62 4U03 TLL 0.0406 0.41779 2.02429
63 1SSQ CYS 0.03888 0.41363 2.02429
64 3I51 45C 0.00597 0.41303 2.02429
65 3VPD CIT 0.0002754 0.41051 2.02429
66 3MG9 GHP 3MY 3FG GHP GHP OMY 3FG 0.009784 0.40811 2.02429
67 2P69 PLP 0.004462 0.40743 2.02429
68 1QDS PGA 0.007102 0.40734 2.02429
69 3HZL 6PC 0.001197 0.40664 2.02429
70 1Z4V DAN 0.03817 0.40282 2.02429
71 1NU4 MLA 0.002394 0.42481 2.06186
72 1AX2 NDG GAL 0.0008239 0.44132 2.09205
73 2GQS ADP 0.01168 0.41775 2.1097
74 2GQR ADP 0.01838 0.40731 2.1097
75 2YC5 6BC 0.003469 0.45462 2.19298
76 1Y7P RIP 0.001117 0.42888 2.24215
77 4JGX PLM 0.004915 0.43365 2.32558
78 3Q3C NAD 0.03956 0.41724 2.34114
79 2E3N 6CM 0.03191 0.41214 2.35294
80 1OGZ EQU 0.00466 0.41768 2.4
81 1FL2 FAD 0.0004571 0.5025 2.42915
82 3PXP MYR 0.00009813 0.49824 2.42915
83 2J07 HDF 0.001279 0.48886 2.42915
84 2J07 FAD 0.001279 0.48886 2.42915
85 4AMV F6R 0.0002217 0.48015 2.42915
86 1VR0 3SL 0.0001244 0.47927 2.42915
87 4NTD FAD 0.001906 0.47044 2.42915
88 1I9G SAM 0.003653 0.46378 2.42915
89 1R6D DAU 0.006665 0.45592 2.42915
90 1R6D NAD 0.007195 0.45503 2.42915
91 3IPQ 965 0.002632 0.45395 2.42915
92 3I0O ADP 0.0006159 0.4528 2.42915
93 1QF5 RPL 0.006718 0.45254 2.42915
94 1QF5 GDP 0.006718 0.45254 2.42915
95 3IO3 ADP 0.001239 0.45189 2.42915
96 4L1F FAD 0.003796 0.45159 2.42915
97 2WIC GNP 0.002087 0.45023 2.42915
98 2OHV NHL 0.0006599 0.44855 2.42915
99 1R37 NAD 0.005928 0.44242 2.42915
100 4L1F COS 0.004061 0.43625 2.42915
101 2EJU SAH 0.003458 0.43212 2.42915
102 2YYJ 4HP 0.0413 0.42982 2.42915
103 2YYJ FAD 0.0413 0.42982 2.42915
104 2J8Z NAP 0.009695 0.42622 2.42915
105 3MTW M3R 0.003892 0.42568 2.42915
106 1TB4 PEJ 0.01095 0.42503 2.42915
107 2Y7G AAE 0.004301 0.42378 2.42915
108 4P05 4NS 0.00713 0.4235 2.42915
109 4M51 BEZ 0.0004847 0.42327 2.42915
110 1V6A TRE 0.0009068 0.42151 2.42915
111 3ANK NG6 GCD 0.003371 0.42121 2.42915
112 1ZUW DGL 0.002922 0.42114 2.42915
113 1R0X ATP 0.01703 0.41954 2.42915
114 1B63 ANP 0.009295 0.41829 2.42915
115 3GJB AKG 0.004359 0.41376 2.42915
116 4E13 NAD 0.01119 0.41298 2.42915
117 4I71 AGV 0.009647 0.41231 2.42915
118 1ZOA 140 0.03879 0.4114 2.42915
119 4HVK PMP 0.00503 0.41112 2.42915
120 1WXI AMP 0.03586 0.40996 2.42915
121 3CKJ CIT 0.01949 0.40947 2.42915
122 3IOI 1GW 0.02657 0.40925 2.42915
123 2TOH HBI 0.02094 0.40526 2.42915
124 4CML 52N 0.02874 0.40227 2.42915
125 4USS GSH 0.007592 0.40077 2.42915
126 1YFZ IMP 0.0009384 0.43561 2.43902
127 1NOX FMN 0.005291 0.42581 2.43902
128 1N07 FMN 0.01901 0.42595 2.45399
129 3HY3 10F 0.003423 0.43962 2.46305
130 2IMF TOM 0.003855 0.43891 2.46305
131 2IMF GSH 0.003855 0.43891 2.46305
132 2OYS FMN 0.002895 0.43939 2.47934
133 1DLJ UGA 0.003564 0.46779 2.48756
134 1DLJ NAI 0.004509 0.46274 2.48756
135 2PVQ GSH 0.005283 0.42195 2.48756
136 3JQM GTP 0.00567 0.40891 2.54777
137 3N5O GSH 0.001421 0.44926 2.55319
138 1Z34 2FD 0.02641 0.42537 2.55319
139 1V2X SAM 0.0008883 0.46041 2.57732
140 4P3H 25G 0.01448 0.43361 2.59067
141 1SS4 CIT 0.02899 0.41468 2.61438
142 3R35 4CO 0.001261 0.47025 2.64901
143 4INB 1F6 0.001163 0.45519 2.73973
144 2OVD DAO 0.00523 0.41807 2.74725
145 4EPM AMP 0.01622 0.40886 2.75387
146 4D7M TDC 0.000186 0.50255 2.76498
147 4OYA 1VE 0.01051 0.46753 2.76596
148 3IL6 B83 0.002334 0.44169 2.80374
149 3NBK PNS 0.04011 0.40071 2.82486
150 1GR0 NAD 0.0006757 0.51889 2.83401
151 1H82 FAD 0.000547 0.51323 2.83401
152 3E8N VRA 0.0006362 0.49777 2.83401
153 3E8N ATP 0.0006362 0.49777 2.83401
154 3DG6 MUC 0.0001502 0.48487 2.83401
155 1H82 GZZ 0.002263 0.48463 2.83401
156 1UOU CMU 0.0003246 0.47032 2.83401
157 3GE7 AFQ 0.001603 0.46803 2.83401
158 1RYI GOA 0.002757 0.46787 2.83401
159 1I0Z NAI 0.001327 0.46781 2.83401
160 4CMF PXG 0.003585 0.46766 2.83401
161 3EAU NDP 0.007766 0.46668 2.83401
162 3EAU PDN 0.007766 0.46668 2.83401
163 2EWM NAD 0.001564 0.46587 2.83401
164 4NE2 ADP 0.001806 0.4656 2.83401
165 4NE2 SH2 0.002037 0.4656 2.83401
166 3T31 FAD 0.004821 0.46446 2.83401
167 3T31 DCQ 0.005164 0.46446 2.83401
168 4KWI 1TJ 0.003001 0.46411 2.83401
169 1RYI FAD 0.003178 0.46291 2.83401
170 3WBF API 0.002139 0.46213 2.83401
171 2IXB A2G 0.002857 0.46201 2.83401
172 4KWI NAP 0.003175 0.46192 2.83401
173 3KMZ EQO 0.001509 0.46074 2.83401
174 4I3V NAD 0.00585 0.45602 2.83401
175 3WBF NAP 0.002236 0.45584 2.83401
176 1R6W 164 0.0008099 0.45553 2.83401
177 3JDW ORN 0.0009707 0.45209 2.83401
178 3I28 34N 0.007385 0.44967 2.83401
179 1VDC FAD 0.008259 0.44812 2.83401
180 2VEZ ACO 0.00339 0.44745 2.83401
181 2VEZ G6P 0.003628 0.44745 2.83401
182 1XP8 AGS 0.007723 0.44698 2.83401
183 1I2B USQ 0.01089 0.44679 2.83401
184 1I2B UPG 0.01089 0.44679 2.83401
185 1I2B NAD 0.01089 0.44679 2.83401
186 3WE0 FAD 0.008509 0.44403 2.83401
187 3KO8 NAD 0.00535 0.44213 2.83401
188 2B4Q NAP 0.005237 0.44001 2.83401
189 4J7H TRH 0.002763 0.43842 2.83401
190 2QS8 MET 0.005771 0.43671 2.83401
191 1I7L ATP 0.004493 0.43425 2.83401
192 4HPP GLU 0.01197 0.42901 2.83401
193 3BW2 FMN 0.009277 0.42841 2.83401
194 2IXB NAD 0.0102 0.42773 2.83401
195 1GSA ADP 0.02164 0.42745 2.83401
196 2C4I BTN 0.003676 0.42676 2.83401
197 2C5S AMP 0.002214 0.42625 2.83401
198 2HEK GDP 0.002632 0.42581 2.83401
199 2C9O ADP 0.01385 0.42265 2.83401
200 3FXU TSU 0.009207 0.42163 2.83401
201 2R85 AMP 0.03483 0.41601 2.83401
202 2QDT I38 0.006661 0.41544 2.83401
203 1UKW FAD 0.02547 0.41532 2.83401
204 4J7H TLO 0.01075 0.41376 2.83401
205 3SIX GDP 0.006196 0.41233 2.83401
206 2ZJ5 ADP 0.003984 0.40948 2.83401
207 1GSA GSH 0.04277 0.40795 2.83401
208 3K56 IS3 0.009324 0.4069 2.83401
209 3UN3 G16 0.02613 0.40687 2.83401
210 1VCO GLN 0.02279 0.40631 2.83401
211 2V5K OXM 0.008519 0.40516 2.83401
212 1VJO PLP 0.01145 0.4051 2.83401
213 1GVF PGH 0.006141 0.40465 2.83401
214 2V9M CIT 0.008521 0.40394 2.83401
215 3ZPG 5GP 0.001004 0.40226 2.83401
216 2DT5 NAD 0.0008659 0.47645 2.8436
217 1C3V NDP 0.002153 0.45938 2.85714
218 1C3V PDC 0.005301 0.40432 2.85714
219 1HDR NAD 0.002168 0.47758 2.86885
220 1FMB HYB 0.006877 0.41037 2.88462
221 2UX9 FMN 0.02172 0.41866 2.89855
222 1NF8 ISC 0.009857 0.4036 2.89855
223 2HNK SAH 0.002278 0.44216 2.92887
224 1VPM COA 0.008865 0.42083 2.95858
225 1MVQ MMA 0.00321 0.45127 2.9661
226 2AC7 ADN 0.02071 0.4234 2.97872
227 4FR3 LYS ARG ARG LYS SEP VAL 0.009502 0.45823 2.99145
228 4FR3 0V4 0.009502 0.45823 2.99145
229 4FGC PQ0 0.008136 0.41062 3.0303
230 1XNK XS2 0.001633 0.44221 3.06122
231 3FPZ AHZ 0.0302 0.43601 3.06748
232 2JBH 5GP 0.002123 0.42702 3.11111
233 3TFC PEP 0.003959 0.41267 3.11688
234 1L3I SAH 0.01187 0.41945 3.125
235 3ZOD FMN 0.0008573 0.47204 3.14136
236 3ZOD HQE 0.0008573 0.47204 3.14136
237 2QXX TTP 0.02125 0.41862 3.15789
238 3A3B RBF 0.01726 0.40121 3.15789
239 2QO4 CHD 0.03901 0.40094 3.1746
240 1WUR 8DG 0.005417 0.4289 3.18182
241 4C12 ADP 0.005092 0.46173 3.19361
242 4C12 UML 0.02048 0.41228 3.19361
243 1G79 PLP 0.02176 0.41763 3.21101
244 1G79 FMN 0.01933 0.41693 3.21101
245 1B4P GPS 0.01275 0.40691 3.22581
246 2AMV BIN 0.001539 0.4858 3.23887
247 2GSD NAD 0.0007744 0.48553 3.23887
248 2ZB3 NDP 0.0005201 0.48524 3.23887
249 4BJZ FAD 0.003265 0.48259 3.23887
250 4BJZ P3A 0.003265 0.48259 3.23887
251 2PUL ACP 0.0002711 0.47633 3.23887
252 3SJ7 NDP 0.001009 0.47188 3.23887
253 3ZEI AWH 0.00114 0.46942 3.23887
254 4WX0 HXD 0.000527 0.4637 3.23887
255 4KGD TDP 0.008479 0.46017 3.23887
256 4KGD FAD 0.00871 0.46017 3.23887
257 1YBH FAD 0.003913 0.45651 3.23887
258 1T57 FMN 0.001351 0.45613 3.23887
259 1WVC CTP 0.01516 0.45362 3.23887
260 2DTX BMA 0.004536 0.45342 3.23887
261 1U5R ATP 0.000935 0.4528 3.23887
262 2NXW TPP 0.003249 0.45231 3.23887
263 4G10 GSH 0.001157 0.44875 3.23887
264 2YBQ SAH 0.002023 0.44446 3.23887
265 3L8W XAN 0.01513 0.44102 3.23887
266 2YBQ UP2 0.007105 0.44091 3.23887
267 3RHZ UDP 0.002308 0.43992 3.23887
268 1UZN NAP 0.001883 0.4395 3.23887
269 1QW9 KHP 0.00406 0.43944 3.23887
270 9LDT NAD 0.006207 0.43785 3.23887
271 3FKQ ATP 0.002349 0.43748 3.23887
272 9LDB NAD 0.006905 0.43568 3.23887
273 3IU9 T07 0.02156 0.43392 3.23887
274 2XBN PMP 0.00545 0.43358 3.23887
275 2A0W DIH 0.008914 0.43344 3.23887
276 3HAZ NAD 0.00787 0.43175 3.23887
277 3WCS MAN NAG GAL 0.002164 0.42945 3.23887
278 3IAE D7K 0.009732 0.42868 3.23887
279 3MAG 3MA 0.006028 0.4279 3.23887
280 2D37 FMN 0.007892 0.42764 3.23887
281 2D37 NAD 0.008458 0.42764 3.23887
282 3KJI ADP 0.00449 0.42296 3.23887
283 1OMZ UD2 0.02312 0.42279 3.23887
284 1A8S PPI 0.003344 0.42265 3.23887
285 3MCT SAH 0.007136 0.42178 3.23887
286 1YBH P22 0.003271 0.42177 3.23887
287 1E1O LYS 0.01001 0.42144 3.23887
288 4LNL PLG 0.004523 0.42059 3.23887
289 1SOW NAD 0.01549 0.42036 3.23887
290 1I52 CTP 0.01419 0.41976 3.23887
291 4LNL 2BK 0.005348 0.41963 3.23887
292 4LNL 2BO 0.005348 0.41963 3.23887
293 3HAZ FAD 0.01668 0.41768 3.23887
294 3WCS MAN NAG 0.003086 0.41722 3.23887
295 3SUC ATP 0.006914 0.41577 3.23887
296 2OI2 DP6 0.005721 0.41383 3.23887
297 2HFK E4H 0.003761 0.41361 3.23887
298 4IMG NGF 0.009986 0.41347 3.23887
299 1YBH CIE 0.009164 0.41138 3.23887
300 1B74 DGN 0.001374 0.40914 3.23887
301 2NU8 COA 0.02005 0.4089 3.23887
302 3MCT 3MC 0.004889 0.40882 3.23887
303 1V1A ADP 0.0232 0.40852 3.23887
304 2NZU BG6 0.005289 0.40738 3.23887
305 3VGL ANP 0.03927 0.4062 3.23887
306 1C7S CBS 0.008808 0.40572 3.23887
307 3ULK NDP 0.01874 0.40447 3.23887
308 4BT5 23B 0.007469 0.40382 3.23887
309 2Z5Y HRM 0.03491 0.40016 3.23887
310 1KOL NAD 0.0113 0.43128 3.26633
311 2E2R 2OH 0.001084 0.47733 3.27869
312 1UAY ADN 0.0005092 0.46183 3.30579
313 3PNL ADP 0.004255 0.43364 3.31754
314 4USQ FAD 0.003609 0.45263 3.3241
315 4FDV 0UK 0.01047 0.42838 3.34928
316 1D6H COA 0.0005484 0.50196 3.35917
317 3NCQ ATP 0.001011 0.45991 3.36134
318 1II5 GLU 0.002589 0.41727 3.43348
319 2PY4 DUP 0.02072 0.42203 3.44828
320 1XOC VAL ASP SER LYS ASN THR SER SER TRP 0.006537 0.44677 3.46154
321 3V1V GST 0.001195 0.45043 3.4642
322 4R3L COA 0.004666 0.42329 3.46821
323 2PAR TMP 0.0185 0.42711 3.48259
324 1XEX ATP 0.001934 0.45257 3.48837
325 2Z9C DTC 0.004307 0.43827 3.5
326 2Z9C FMN 0.01463 0.40603 3.5
327 2OFE NAG 0.001254 0.42681 3.52113
328 2XBP ATP 0.02731 0.42126 3.53982
329 2X0K PPV 0.005238 0.40607 3.5503
330 1MQ0 BRD 0.006514 0.41369 3.57143
331 3EE4 MYR 0.0002439 0.4876 3.64372
332 2V7T SAH 0.004309 0.48415 3.64372
333 2ZJ3 G6P 0.0003262 0.47982 3.64372
334 1REO FAD 0.001409 0.47785 3.64372
335 3TO7 COA 0.001622 0.4738 3.64372
336 1TFZ 869 0.0004747 0.47255 3.64372
337 1LTH NAD 0.004217 0.4658 3.64372
338 1YB5 NAP 0.002192 0.46288 3.64372
339 3D2Y AH0 ALA FGA LYS 0.0007246 0.46223 3.64372
340 3PVT 3HC 0.00271 0.462 3.64372
341 4F2Q QUS 0.0005431 0.46061 3.64372
342 1SAY PYR 0.01892 0.45976 3.64372
343 2Q1W NAD 0.002499 0.45767 3.64372
344 2Q28 ADP 0.001062 0.45695 3.64372
345 3LM9 FRU 0.001718 0.45492 3.64372
346 1GV0 NAD 0.002667 0.45368 3.64372
347 4BG1 OGA 0.001633 0.45056 3.64372
348 4BG1 IVL 0.001633 0.45056 3.64372
349 1G0N PHH 0.005885 0.44995 3.64372
350 1ULE GLA GAL NAG 0.00009883 0.44977 3.64372
351 1G0N NDP 0.005188 0.44958 3.64372
352 3HF3 FMN 0.001932 0.44912 3.64372
353 1RKD ADP 0.004762 0.44451 3.64372
354 1RKD RIB 0.004762 0.44451 3.64372
355 2NLI LAC 0.01156 0.4425 3.64372
356 2NLI FMN 0.01156 0.4425 3.64372
357 3O2K QRP 0.00115 0.44119 3.64372
358 1L1Q 9DA 0.002828 0.43797 3.64372
359 2DVZ GLU 0.001575 0.43535 3.64372
360 1E2S CSN 0.002189 0.4343 3.64372
361 1GPJ CIT 0.0008522 0.43371 3.64372
362 2Q28 TPP 0.005443 0.4336 3.64372
363 4MZ7 DGT 0.007183 0.4336 3.64372
364 1XVV CCQ 0.01299 0.43138 3.64372
365 1DXY NAD 0.006884 0.43038 3.64372
366 2I7C AAT 0.0109 0.42874 3.64372
367 1B0U ATP 0.003429 0.42809 3.64372
368 4C6F NCD 0.002338 0.42801 3.64372
369 4C6F DOR 0.002338 0.42801 3.64372
370 3ZY6 GFB 0.005276 0.42768 3.64372
371 2DDH FAD 0.01151 0.42762 3.64372
372 3ZGE ASP 0.0003657 0.42737 3.64372
373 4BAS GNP 0.005803 0.42582 3.64372
374 3W68 VIV 0.01043 0.42264 3.64372
375 2DDH HXD 0.006942 0.42232 3.64372
376 1S4M LUM 0.0188 0.42072 3.64372
377 4HE2 AMP 0.01459 0.42042 3.64372
378 1EYE PMM 0.004188 0.41968 3.64372
379 2HW1 ANP 0.008271 0.4189 3.64372
380 1DXY COI 0.0002679 0.41884 3.64372
381 2DKH 3HB 0.0341 0.41709 3.64372
382 1NJR XYL 0.01679 0.41381 3.64372
383 2ZJF BSU 0.005052 0.41368 3.64372
384 1OLS TDP 0.03826 0.4128 3.64372
385 4MZ7 DTP 0.02043 0.41233 3.64372
386 3LM9 ADP 0.006375 0.41179 3.64372
387 4N4J HG1 0.03387 0.41163 3.64372
388 2CJH AKG 0.008841 0.41004 3.64372
389 3RSR N5P 0.03605 0.40894 3.64372
390 4QDC ASD 0.02116 0.40848 3.64372
391 2BJF DXC 0.04563 0.40655 3.64372
392 3RGA LSB 0.01783 0.40475 3.64372
393 1I1Q TRP 0.006291 0.40699 3.64583
394 1F7K UMP 0.02045 0.40916 3.67647
395 2ZMF CMP 0.005813 0.43469 3.7037
396 4FUA PGH 0.001641 0.45907 3.72093
397 1NN5 2DT 0.004658 0.44239 3.72093
398 1NN5 ANP 0.004658 0.44239 3.72093
399 4M4Q 21A 0.003444 0.44114 3.73444
400 1ZJ6 G3D 0.001119 0.44441 3.74332
401 1HFS L04 0.0001123 0.52092 3.75
402 1UW1 ADP 0.0124 0.40081 3.75
403 4JP3 CIT 0.001241 0.44248 3.76569
404 2FQO HYI 0.02013 0.40605 3.82166
405 2F59 INI 0.01363 0.40562 3.82166
406 2FWP CIT 0.01805 0.41606 3.82514
407 4NVP 7CH 0.002474 0.46159 3.82775
408 2UZ2 BTN 0.002984 0.43073 3.84615
409 4LWA Q13 0.04303 0.40608 3.85675
410 3IBH GSH 0.005986 0.42342 3.86266
411 2F5T MAL 0.01057 0.41055 3.86266
412 4U9W COA 0.0041 0.42681 3.86473
413 2F3R G5P 0.03953 0.40572 3.86473
414 4BI7 PGA 0.003148 0.41976 3.89105
415 1XIU REA 0.00103 0.45326 3.91304
416 2YDW WSH 0.003848 0.41875 3.92157
417 4B8V NDG NAG NAG NAG 0.004991 0.43682 3.94737
418 3NYQ MCA 0.01289 0.42413 3.9604
419 3NYQ AMP 0.01887 0.41742 3.9604
420 3NGU ADP 0.007511 0.411 3.97351
421 2ET1 GLV 0.00866 0.40755 3.9801
422 1BGQ RDC 0.0000496 0.52895 4
423 2XRH NIO 0.002944 0.40289 4
424 1DAK ADP 0.00723 0.44466 4.01786
425 1DAK DPU 0.00723 0.44466 4.01786
426 2IYG FMN 0.00185 0.435 4.03226
427 1RM0 D6P 0.0002696 0.52214 4.04858
428 2Q1S NAI 0.0006045 0.49991 4.04858
429 1SB8 UD2 0.001646 0.48606 4.04858
430 2VHJ ADP 0.000245 0.48536 4.04858
431 1SB8 NAD 0.001824 0.48038 4.04858
432 4PB2 5UD 0.0003393 0.47683 4.04858
433 3PFG SAM 0.001787 0.47395 4.04858
434 3PFG TLO 0.001787 0.47395 4.04858
435 1G6O ADP 0.0008686 0.47013 4.04858
436 3ICC NAP 0.002102 0.4612 4.04858
437 2R42 FPS 0.001318 0.45277 4.04858
438 1SQ5 ADP 0.0007276 0.45248 4.04858
439 3MB5 SAM 0.007394 0.45212 4.04858
440 3RFV 15L 0.002413 0.45136 4.04858
441 2YVF NAD 0.01104 0.45059 4.04858
442 2YVF FAD 0.01089 0.45023 4.04858
443 1RM0 NAI 0.007186 0.44939 4.04858
444 3QUR ADP 0.00404 0.44659 4.04858
445 3QUR FM4 0.00404 0.44659 4.04858
446 1RP0 AHZ 0.01932 0.44184 4.04858
447 3AHC TPP 0.004843 0.4416 4.04858
448 2RDT FMN 0.01509 0.4397 4.04858
449 2RDT 2RD 0.0202 0.4397 4.04858
450 1V9N NDP 0.006297 0.4388 4.04858
451 1GAD NAD 0.004585 0.43852 4.04858
452 1X1T NAD 0.02631 0.43603 4.04858
453 3NNF AKG 0.0007877 0.43512 4.04858
454 2O4J VD4 0.006445 0.4317 4.04858
455 3W54 RNB 0.002552 0.43141 4.04858
456 4KXV TDP DX5 0.01281 0.43071 4.04858
457 1UNB PN1 0.01612 0.42591 4.04858
458 1UNB AKG 0.01452 0.42591 4.04858
459 2QJN KDG 0.003423 0.42586 4.04858
460 3CQD ATP 0.01648 0.42444 4.04858
461 4GZP G39 0.01839 0.42408 4.04858
462 2G86 UMP 0.02822 0.42247 4.04858
463 1DSS NAD 0.01007 0.42133 4.04858
464 1SQ5 PAU 0.002872 0.41854 4.04858
465 1Q7E MET 0.01517 0.41451 4.04858
466 3ZRR PXG 0.009608 0.41422 4.04858
467 1M7Y PPG 0.0196 0.41318 4.04858
468 1QR0 COA 0.005341 0.41265 4.04858
469 1P72 THM 0.004563 0.41008 4.04858
470 2CE7 ADP 0.008155 0.40944 4.04858
471 1CTU ZEB 0.0134 0.40408 4.04858
472 1PGP 6PG 0.04211 0.40377 4.04858
473 3RFV NAI 0.02851 0.40307 4.04858
474 1P72 ADP 0.0382 0.40062 4.04858
475 2Z81 PCJ 0.04279 0.40001 4.04858
476 3QVL 5HY 0.03815 0.41735 4.08163
477 1YRX FMN 0.005343 0.41744 4.13223
478 1F7L COA 0.02546 0.41177 4.13223
479 1EJE FMN 0.0009657 0.4567 4.16667
480 3QDX CBS 0.0006838 0.4286 4.1958
481 3QDW NDG 0.0008315 0.42551 4.1958
482 3QDY CBS 0.001398 0.41727 4.1958
483 3QDV NDG 0.002895 0.40217 4.1958
484 4E1N TQX 0.0086 0.41982 4.21687
485 3SFI 3SF 0.001755 0.47434 4.23729
486 3TA2 AKG 0.004979 0.4397 4.23729
487 3TA2 ATP 0.01843 0.41846 4.23729
488 2ORV 4TA 0.003216 0.4425 4.2735
489 1NML CIT 0.0006794 0.44484 4.29448
490 4G09 0VD 0.01334 0.40218 4.3379
491 2HVW DDN 0.00007695 0.49748 4.34783
492 1G8S MET 0.005143 0.40159 4.34783
493 2HVW DCP 0.01336 0.40008 4.34783
494 4M37 SAH 0.004076 0.43088 4.37318
495 2ASF CIT 0.011 0.41656 4.37956
496 3HMO STU 0.009997 0.41919 4.38596
497 1U7Z PMT 0.001667 0.46723 4.42478
498 1IS3 LAT 0.003479 0.41341 4.44444
499 4FWE FAD 0.001069 0.48787 4.45344
500 2Q2V NAD 0.0007601 0.4833 4.45344
501 3Q9T FAY 0.00104 0.48305 4.45344
502 2RGH FAD 0.001702 0.47498 4.45344
503 1AUX AGS 0.0004369 0.46968 4.45344
504 2R40 20E 0.0008226 0.46949 4.45344
505 2VJJ RAM GLC GAL NAG NAG GLC 0.003323 0.46887 4.45344
506 2R40 EPH 0.001415 0.46722 4.45344
507 1O0S NAI 0.0009466 0.46495 4.45344
508 2BLE 5GP 0.005687 0.46378 4.45344
509 3FC4 EDO 0.004945 0.46315 4.45344
510 3M0J OAF 0.001898 0.46195 4.45344
511 1RYD NDP 0.003285 0.45801 4.45344
512 4O1M NAD 0.002279 0.45687 4.45344
513 1E4E ADP 0.001045 0.45518 4.45344
514 1E4E PHY 0.0009053 0.45341 4.45344
515 1N1G BCP 0.004114 0.4511 4.45344
516 4DQ2 BTX 0.002961 0.45018 4.45344
517 2PTR 2SA 0.002642 0.44955 4.45344
518 2QA1 FAD 0.004958 0.44725 4.45344
519 4OB6 S2T 0.001255 0.44721 4.45344
520 1OWB NAD 0.003796 0.4472 4.45344
521 3CXO 3LR 0.003773 0.44529 4.45344
522 1Z48 FMN 0.001635 0.44217 4.45344
523 2PTZ PAH 0.001694 0.4415 4.45344
524 1Z41 FMN 0.001741 0.44099 4.45344
525 2CSN CKI 0.003992 0.43978 4.45344
526 3I8P 840 0.0019 0.43932 4.45344
527 2DWU DGL 0.001434 0.43426 4.45344
528 2VAR AMP 0.001778 0.4331 4.45344
529 3JYN NDP 0.009187 0.43225 4.45344
530 1KYZ SAH 0.003558 0.43157 4.45344
531 2ZX7 ZX7 0.008514 0.43079 4.45344
532 1KYZ FER 0.007624 0.42973 4.45344
533 1Z42 FMN 0.003298 0.42416 4.45344
534 2P1M IHP 0.008905 0.42378 4.45344
535 4NM5 ADP 0.007035 0.42377 4.45344
536 1H6W SER LEU ASN TYR ILE ILE LYS VAL LYS GLU 0.0271 0.42372 4.45344
537 3B1F NAD 0.007092 0.42361 4.45344
538 1E7S NAP 0.01336 0.42339 4.45344
539 4IOK ADP 0.009809 0.42328 4.45344
540 2QIA U20 0.03259 0.42184 4.45344
541 3CXO 1N5 0.01722 0.41702 4.45344
542 1H6C NDP 0.02427 0.41634 4.45344
543 1O0D 163 0.007142 0.41617 4.45344
544 1FDJ 2FP 0.005059 0.41614 4.45344
545 4IOK XPO 0.01142 0.41583 4.45344
546 4JDR FAD 0.04961 0.41341 4.45344
547 2WL9 MBD 0.01423 0.41297 4.45344
548 2VAR KDF 0.00618 0.41238 4.45344
549 4QDF 30Q 0.0183 0.41141 4.45344
550 2FEQ 34P 0.009169 0.41137 4.45344
551 4AF0 IMP 0.04576 0.41122 4.45344
552 1PX8 XYP 0.003912 0.40981 4.45344
553 1RYD GLC 0.003327 0.40938 4.45344
554 2VAR ANP 0.01366 0.40908 4.45344
555 1FS5 TLA 0.02094 0.40869 4.45344
556 4QCK ASD 0.01922 0.40839 4.45344
557 2P1O NLA 0.02496 0.40823 4.45344
558 2P1O IHP 0.02496 0.40823 4.45344
559 2A2X NA9 0.012 0.40809 4.45344
560 2VAR KDG 0.008281 0.40688 4.45344
561 1EB1 ASP TYR GLU PRO ILE PRO GLU GLU ALA PHE 0.01383 0.40626 4.45344
562 4RNX FMN 0.01529 0.40603 4.45344
563 2Q1A 2KT 0.01913 0.40405 4.45344
564 4AF0 MOA 0.02282 0.40354 4.45344
565 3B9Z CO2 0.004717 0.40314 4.45344
566 2GNK ATP 0.007572 0.41699 4.46429
567 1POC GEL 0.0008056 0.45797 4.47761
568 1A27 NAP 0.004021 0.44537 4.49827
569 3LEO GSH 0.02615 0.40607 4.51613
570 1LVG 5GP 0.004152 0.43673 4.54545
571 4LTN NAI 0.009835 0.44438 4.56853
572 4LTN FMN 0.02793 0.41875 4.56853
573 4U36 TNR 0.002936 0.4443 4.58333
574 3ZZS TRP 0.005924 0.44357 4.61538
575 1V8K ANP 0.01915 0.41485 4.63415
576 2Q97 ATP 0.008573 0.41988 4.65116
577 2YLD CMO 0.00178 0.42056 4.72441
578 1UDB UFG 0.005476 0.45937 4.73373
579 1UDB NAD 0.005476 0.45937 4.73373
580 3O9P MHI 0.01774 0.44198 4.81696
581 1V7R CIT 0.01532 0.40798 4.83871
582 1EXB NDP 0.01862 0.44379 4.85437
583 3OND ADN 0.001629 0.4828 4.8583
584 3OND NAD 0.001629 0.4828 4.8583
585 4N02 FNR 0.002852 0.47423 4.8583
586 1M5B BN1 0.003391 0.47361 4.8583
587 4GYW UDP 0.001256 0.47169 4.8583