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Receptor
PDB id Resolution Class Description Source Keywords
3MWU 1.98 Å EC: 2.7.11.17 ACTIVATED CALCIUM-DEPENDENT PROTEIN KINASE 1 FROM CRYPTOSPOR PARVUM (CPCDPK1) IN COMPLEX WITH BUMPED KINASE INHIBITOR RM CRYPTOSPORIDIUM PARVUM SERINE/THREONINE PROTEIN KINASE TRANSFERASE CALCIUM-BINDINBINDING CALMODULIN BUMPED KINASE INHIBITOR BKI STRUCTURGENOMICS MEDICAL STRUCTURAL GENOMICS OF PATHOGENIC PROTOZOTRANSFERASE-TRANSFERASE INHIBITOR COMPLEX
Ref.: DISCOVERY OF POTENT AND SELECTIVE INHIBITORS OF CALCIUM-DEPENDENT PROTEIN KINASE 1 (CDPK1) FROM C. AND T. GONDII. ACS MED CHEM LETT V. 1 331 2010
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
BK3 A:561;
Valid;
none;
submit data
372.466 C22 H24 N6 c1ccc...
CA A:551;
A:552;
A:553;
A:554;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
none;
none;
none;
none;
submit data
40.078 Ca [Ca+2...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3IGO 2.25 Å EC: 2.7.11.17 CRYSTAL STRUCTURE OF CRYPTOSPORIDIUM PARVUM CDPK1, CGD3_920 CRYPTOSPORIDIUM PARVUM PARASITE KINASE CDPK STRUCTURAL GENOMICS STRUCTURAL GENOCONSORTIUM SGC ATP-BINDING NUCLEOTIDE-BINDING SERINE/THPROTEIN KINASE TRANSFERASE
Ref.: STRUCTURES OF APICOMPLEXAN CALCIUM-DEPENDENT PROTEI REVEAL MECHANISM OF ACTIVATION BY CALCIUM. NAT.STRUCT.MOL.BIOL. V. 17 596 2010
Members (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 10 families.
1 3IGO - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
2 3NCG - BK1 C19 H19 N5 CC(C)n1c2c....
3 3MWU - BK3 C22 H24 N6 c1ccc2c(c1....
70% Homology Family (21)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 5 families.
1 3IGO - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
2 3NCG - BK1 C19 H19 N5 CC(C)n1c2c....
3 3MWU - BK3 C22 H24 N6 c1ccc2c(c1....
4 4ONA ic50 = 0.002 uM UW1 C19 H23 N5 O2 CCOc1ccc2c....
5 4JBV ic50 = 0.003 uM V68 C26 H32 N6 O CC(C)COc1c....
6 3NYV - DTQ C16 H15 N3 O3 COc1cc2c(c....
7 3T3U Ki = 0.0025 uM BK6 C22 H24 N6 O COc1ccc2cc....
8 3KU2 - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
9 4M84 ic50 = 0.049 uM 21E C17 H19 N5 O CC(C)(C)n1....
10 3HX4 - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
11 3UPX Ki = 0.0075 uM B6A C20 H22 N4 O c1ccc(cc1)....
12 3SXF Ki = 0.0025 uM BK5 C20 H21 N5 O CCOc1ccc2c....
13 3T3V Ki = 0.003 uM BK4 C19 H19 N5 O CC(C)n1c2c....
14 3I7B ic50 = 0.066 uM BK1 C19 H19 N5 CC(C)n1c2c....
15 3V5P Ki = 0.011 uM C88 C19 H24 N6 O Cc1cc(ccc1....
16 3V51 - I76 C25 H22 Cl N5 O CC(C)n1c2c....
17 3UPZ - B5A C11 H16 N6 c1c2c(ncnc....
18 3I7C ic50 = 0.018 uM BK2 C19 H19 N5 CC(C)(C)n1....
19 3V5T - UW9 C24 H30 N6 O CCOc1ccc2c....
20 3N51 - BK3 C22 H24 N6 c1ccc2c(c1....
21 3HZT - J60 C22 H27 Cl N4 O2 CCN(CC)CCN....
50% Homology Family (420)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 3IGO - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
2 3NCG - BK1 C19 H19 N5 CC(C)n1c2c....
3 3MWU - BK3 C22 H24 N6 c1ccc2c(c1....
4 2XF0 ic50 = 30 uM 4UB C15 H11 N5 c1ccc(cc1)....
5 2YM6 ic50 = 0.88 uM YM6 C14 H16 N6 O c1cncc2c1c....
6 6FCK ic50 = 0.031 uM D4Z C20 H22 N4 O c1ccc(cc1)....
7 4QYG ic50 = 0.0041 uM 3DW C22 H21 N5 O2 CN1CCN(CC1....
8 3TKH ic50 = 47 nM 07S C23 H27 N7 O2 S c1cc(cnc1)....
9 2XEZ ic50 = 1.5 uM XEZ C12 H9 N7 c1c[nH]nc1....
10 2HXL ic50 = 12 nM 422 C23 H24 N6 c1cc2c(cc1....
11 5OQ7 ic50 = 0.8743 uM A0Q C24 H26 N4 O2 CN1CCN(CC1....
12 5F4N ic50 = 2.2 nM 5UY C17 H19 N7 O3 COC(=O)c1c....
13 2E9N ic50 = 6.2 nM 76A C29 H27 N3 O3 c1cc(ccc1c....
14 2YM3 ic50 = 1.2 uM YM3 C14 H19 N5 O3 CCOC(=O)c1....
15 2YDI - YDI C16 H20 N4 O3 S CN(C)CCOc1....
16 5OP5 ic50 = 0.4964 uM 3FE C17 H15 N5 O c1cc(cc(c1....
17 3NLB ic50 = 35 nM 5BE C21 H28 N6 O Cc1c(c([nH....
18 3JVR Ki = 1.89 uM AGX C16 H13 Cl2 N3 O2 C[C@@H](c1....
19 2WMX ic50 = 0.86 uM ZY6 C17 H19 N5 O c1ccc(cc1)....
20 2C3J Ki = 0.659 uM DBQ C11 H11 N5 O2 c1c[nH]c2c....
21 2YM7 ic50 = 0.13 uM YM7 C15 H18 N8 c1c(ncnc1N....
22 2X8I ic50 = 0.19 uM X8I C17 H13 N3 O2 CC1=CC2=NN....
23 2YDJ ic50 = 0.005 uM YDJ C17 H19 F N4 O2 S c1cc(cc(c1....
24 4QYE ic50 = 1.2 uM 3DL C17 H12 N2 O3 c1cc(cc(c1....
25 5OP7 - A1K C19 H21 Cl N6 O3 CNc1c2c(c[....
26 5OOP - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
27 5OPR ic50 = 5.8506 uM A3E C21 H26 N6 O CC(C)n1cc(....
28 2BRG ic50 = 6.1 uM DFY C21 H19 N3 O2 CN(CCO)c1c....
29 5OQ5 ic50 = 0.052 uM 4K4 C31 H38 N8 O3 CN1CCN(CC1....
30 2CGU ic50 = 13.4 uM 3A3 C17 H13 N O7 c1cc-2c(cc....
31 2WMR ic50 = 52 uM ZYR C10 H10 N2 O S C1CCc2c(c3....
32 3PA5 ic50 = 2 nM C73 C17 H19 Cl N4 O2 S c1cc(ccc1c....
33 2WMV ic50 = 9.2 uM ZYV C10 H14 N6 O c1[nH]c2c(....
34 5OQ8 ic50 = 4.0577 uM A0Q C24 H26 N4 O2 CN1CCN(CC1....
35 2CGX ic50 = 15.6 uM 3D3 C7 H8 N6 O S c1nc(c2c(n....
36 4QYF - 3DV C17 H13 N3 O3 c1cc(cc(c1....
37 5OPS ic50 = 1.9827 uM A3Q C14 H9 N3 O c1cc(cc(c1....
38 3JVS Ki = 0.146 uM AGY C22 H22 N4 O4 CC(C)(C)c1....
39 2WMW ic50 = 0.39 uM ZYW C11 H14 Br N5 O c1c2c(c(cn....
40 2BR1 Ki = 7.2 uM PFP C22 H21 N3 O4 COc1ccc(cc....
41 2C3L Ki = 0.026 uM IDZ C14 H10 N4 c1ccc2c(c1....
42 5OP2 ic50 = 0.5543 uM A0Q C24 H26 N4 O2 CN1CCN(CC1....
43 2X8E ic50 = 0.014 uM X8E C16 H12 N4 O CC1=CC2=NN....
44 2X8D ic50 = 0.8 uM X8D C11 H9 N3 O CC1=CC2=NN....
45 2YEX ic50 = 0.0001 uM YEX C15 H12 N4 O CC1=CC2=NN....
46 2BRM Ki = 1.3 uM DFZ C20 H18 N4 O c1ccc(cc1)....
47 1NVQ Ki = 5.6 nM UCN C28 H26 N4 O4 C[C@@]12[C....
48 5OOR - STU C28 H26 N4 O3 C[C@@]12[C....
49 3PA4 ic50 = 3 nM C72 C19 H19 Cl N4 O S c1cc(ccc1c....
50 4RVK ic50 = 13.5 nM 3XK C19 H13 N5 O CC(=O)Nc1c....
51 2HOG ic50 = 0.3 nM 710 C24 H25 N7 O c1cc2c(cc1....
52 6FC8 ic50 = 0.012 uM D4Q C19 H19 F N4 O S c1cc(cc(c1....
53 3LFN Ki = 3160 nM A27 C23 H21 N3 O2 CCCC(=O)Nc....
54 3PY1 Kd = 37 uM 2AN C16 H13 N O3 S c1ccc(cc1)....
55 2A4L ic50 = 0.4 uM RRC C19 H26 N6 O CC[C@H](CO....
56 1Y8Y ic50 = 2 uM CT7 C13 H11 Cl N4 O2 S CS(=O)(=O)....
57 6GUH Kd = 26 nM FB8 C18 H21 N5 O2 S Cc1ncc(n1C....
58 1OIR ic50 = 0.032 uM HDY C23 H26 N6 O2 Cc1c(n2ccc....
59 1PXJ - CK2 C9 H10 N4 S Cc1c(sc(n1....
60 2VTO ic50 = 0.14 uM LZ8 C17 H13 F N4 O2 c1ccc(cc1)....
61 2BTR ic50 = 95 nM U73 C13 H15 N3 O S CC(C)C1=CN....
62 2VTA ic50 = 185 uM LZ1 C7 H6 N2 c1ccc2c(c1....
63 3EZR - EZR C26 H27 N7 O CN1CCN(CC1....
64 3ULI ic50 = 0.07 uM 1N3 C21 H25 Br N6 O2 COc1ccc(cc....
65 2DS1 ic50 = 6.4 nM 1CD C22 H21 N5 O3 C[C@@H]1C[....
66 5FP5 - 1Y6 C7 H5 F O2 c1cc(ccc1C....
67 2VTH ic50 = 120 uM LZ2 C10 H9 N O3 S c1cc2c(ccc....
68 1KE5 ic50 = 560 nM LS1 C16 H15 N3 O3 S CNS(=O)(=O....
69 3FZ1 - B98 C13 H15 N3 O2 S COc1ccc2c(....
70 1WCC ic50 = 350 uM CIG C4 H4 Cl N3 c1c(nc(cn1....
71 1PXO Ki = 2 nM CK7 C14 H12 N6 O2 S Cc1c(sc(n1....
72 1H00 ic50 = 38 uM FAP C21 H23 F2 N5 O2 CN(C)C[C@@....
73 2R3R - 6SC C18 H14 Br N5 c1ccc(cc1)....
74 1B39 Kd = 0.12 uM ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
75 3PXF Kd = 37 uM 2AN C16 H13 N O3 S c1ccc(cc1)....
76 3TI1 - B49 C22 H27 F N4 O2 CCN(CC)CCN....
77 2R3G ic50 = 800 nM SC9 C18 H14 F N5 c1ccc(c(c1....
78 2C69 ic50 = 26 uM CT8 C17 H14 Br N6 c1cc(cc(c1....
79 2VTM ic50 ~ 1 mM LZM C7 H4 N4 c1cnc2c(cn....
80 4ERW - STU C28 H26 N4 O3 C[C@@]12[C....
81 1E1V Ki = 12 uM CMG C12 H17 N5 O c1[nH]c2c(....
82 2VV9 ic50 = 0.017 uM IM9 C23 H29 N7 O2 Cc1ncc(n1C....
83 5IEV - R0N C18 H23 F3 N4 O3 S C[C@H]([C@....
84 4D1X - ESJ C11 H8 N2 O3 S2 c1cc2c(cc1....
85 5MHQ - 8QT C19 H27 N7 O CC[C@@H]([....
86 2BTS ic50 = 20 nM U32 C12 H15 N3 O2 S2 CC(C)c1cnc....
87 1URW ic50 < 0.003 uM I1P C21 H24 N8 O2 S CN(C)CCCNS....
88 5FP6 - MFZ C11 H7 Cl2 N O c1cc(c2c(c....
89 1CKP - PVB C20 H25 Cl N6 O3 CC(C)[C@H]....
90 1KE6 ic50 = 5.7 nM LS2 C17 H15 N5 O3 S2 CNS(=O)(=O....
91 2C6K ic50 = 0.73 uM DT2 C17 H21 N7 O2 S c1cc(ccc1N....
92 2R3Q - 5SC C19 H16 Br N5 O Cc1ccccc1c....
93 1OIT ic50 < 0.003 uM HDT C17 H14 N6 O2 S c1ccn2c(c1....
94 3NS9 ic50 = 0.003 uM NS9 C20 H27 N5 O3 CC(C)c1cnn....
95 1H01 ic50 = 22 uM FAL C21 H23 Cl2 N5 O2 CN(C)C[C@H....
96 2EXM - ZIP C10 H13 N5 CC(=CCNc1c....
97 4BGH ic50 = 4 nM 3I6 C13 H16 Br N5 O3 S C[C@H](CO)....
98 2R3F ic50 = 500 nM SC8 C18 H13 Cl2 N5 c1cc(c(c(c....
99 1GII - 1PU C17 H16 N4 O2 c1ccnc(c1)....
100 2R64 ic50 = 0.03 uM 740 C23 H27 N5 O3 S c1cc(ccc1C....
101 5A14 - LQ5 C24 H26 F3 N7 O2 CN1CCN(CC1....
102 2C6L ic50 = 0.27 uM DT4 C17 H22 N8 O2 S c1cc(ccc1N....
103 2W06 - FRV C18 H20 N6 O2 S Cc1ncc(n1C....
104 4EZ7 - STU C28 H26 N4 O3 C[C@@]12[C....
105 5D1J ic50 = 48 nM 56H C17 H24 N4 O2 S2 CC(C)(C)c1....
106 5IEY - 6AE C14 H19 N5 O3 S C[C@H]([C@....
107 2VTT ic50 = 0.044 uM LZD C16 H17 F2 N5 O2 c1cc(c(c(c....
108 2VU3 ic50 = 0.047 uM LZE C16 H17 Cl2 N5 O2 c1cc(c(c(c....
109 2B54 - D05 C20 H15 Cl3 N4 O3 CCc1c2c(n(....
110 1GZ8 - MBP C10 H13 N5 O2 CC(C)C(=O)....
111 3PY0 ic50 = 0.13 uM SU9 C13 H11 N3 O2 COc1ccc2c(....
112 2VTR ic50 = 1.5 uM LZB C10 H10 Cl N5 CC(C)Nc1cc....
113 1E1X Ki = 1.3 uM NW1 C11 H17 N5 O2 C1CCC(CC1)....
114 3UNJ ic50 = 11 uM 0BX C17 H14 N4 O2 c1ccc(cc1)....
115 2A0C - CK9 C19 H26 N6 O2 CC[C@H](CO....
116 3TIY - TIY C11 H8 O5 c1c2c(c(c(....
117 2R3I ic50 = 1000 nM SCF C18 H14 F N5 c1ccc(c(c1....
118 1VYZ ic50 = 290 nM N5B C13 H13 N3 O c1ccc(cc1)....
119 3WBL ic50 = 23 uM PDY C20 H26 N6 O CCOc1ccc(c....
120 4RJ3 ic50 = 93 nM 3QS C22 H28 N6 O COC1CCN(CC....
121 2VTN ic50 = 0.85 uM LZ7 C12 H11 F N4 O2 CC(=O)Nc1c....
122 1AQ1 - STU C28 H26 N4 O3 C[C@@]12[C....
123 2C6M ic50 = 0.35 uM DT5 C17 H20 N6 O3 S c1cc(ccc1N....
124 2R3L ic50 = 100 nM SCW C18 H14 Br N5 c1ccc(cc1)....
125 1H08 - BYP BWP n/a n/a
126 1B38 Kd = 0.254 uM ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
127 2B52 ic50 = 8 nM D42 C21 H23 N7 O2 S Cc1c(sc(n1....
128 1PXL - CK4 C16 H13 F3 N4 S Cc1c(sc(n1....
129 3S2P ic50 = 0.068 uM PMU C17 H22 N4 O3 CC(C)c1cc(....
130 2R3O ic50 = 600 nM 2SC C19 H17 N5 O c1ccc(cc1)....
131 3IGG ic50 = 95 nM EFQ C16 H19 N3 O3 COc1ccc(cc....
132 1R78 ic50 = 3 nM FMD C20 H20 F N3 O4 C[C@H]([C@....
133 2FVD Ki = 0.003 uM LIA C18 H21 F2 N5 O4 S COc1ccc(c(....
134 2VTL ic50 = 97 uM LZ5 C10 H9 N3 O c1ccc(cc1)....
135 1KE9 ic50 = 660 nM LS5 C16 H15 N5 O3 S c1ccc2c(c1....
136 1PYE ic50 = 0.32 uM PM1 C21 H13 F2 N3 O2 c1ccc(cc1)....
137 4EZ3 - 0S0 C11 H10 N4 O4 S c1cc(ccc1/....
138 1H07 ic50 = 3 uM MFP C24 H27 Br N6 O2 Cc1ccc(c(c....
139 2B53 ic50 = 0.6 uM D23 C19 H19 F3 N4 CC(C)(C)Nc....
140 6GUK Kd = 725 nM FC8 C19 H24 Cl N7 CCn1cnc2c1....
141 2DUV ic50 = 0.087 uM 371 C19 H17 N O7 S Cc1cc2c(c(....
142 4D1Z - WG8 C13 H10 N2 O3 S c1cc2ccc(n....
143 4ACM Ki = 210 nM 7YG C20 H23 N7 O3 S CN(C)CCNS(....
144 2C5Y ic50 = 0.25 uM MTW C19 H15 N7 O2 c1cc(cc(c1....
145 2R3K ic50 = 100 nM SCQ C18 H14 Br N5 c1ccc(cc1)....
146 2V0D - C53 C9 H7 N3 O S [H]/N=C1/N....
147 2W1H ic50 = 0.052 uM L0F C17 H13 N5 O c1ccc(cc1)....
148 1Y91 ic50 = 0.059 uM CT9 C23 H33 N7 O2 S CC(C)c1cnn....
149 4FII - ARG PRO LYS PRO LEU VAL ASP PRO n/a n/a
150 4NJD ic50 = 0.79 uM NJD C21 H20 N8 O COc1nc(nc(....
151 4JDK - ARG ARG ARG ARG SER TRP TYR n/a n/a
152 5XVG Ki = 0.009 uM 8FX C20 H22 Cl N7 O C[C@@H]1CN....
153 2ZV2 - 609 C19 H10 N2 O3 c1ccc2c(c1....
154 4ONA ic50 = 0.002 uM UW1 C19 H23 N5 O2 CCOc1ccc2c....
155 4JBV ic50 = 0.003 uM V68 C26 H32 N6 O CC(C)COc1c....
156 3NYV - DTQ C16 H15 N3 O3 COc1cc2c(c....
157 3T3U Ki = 0.0025 uM BK6 C22 H24 N6 O COc1ccc2cc....
158 3KU2 - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
159 4M84 ic50 = 0.049 uM 21E C17 H19 N5 O CC(C)(C)n1....
160 3HX4 - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
161 3UPX Ki = 0.0075 uM B6A C20 H22 N4 O c1ccc(cc1)....
162 3SXF Ki = 0.0025 uM BK5 C20 H21 N5 O CCOc1ccc2c....
163 3T3V Ki = 0.003 uM BK4 C19 H19 N5 O CC(C)n1c2c....
164 3I7B ic50 = 0.066 uM BK1 C19 H19 N5 CC(C)n1c2c....
165 3V5P Ki = 0.011 uM C88 C19 H24 N6 O Cc1cc(ccc1....
166 3V51 - I76 C25 H22 Cl N5 O CC(C)n1c2c....
167 3UPZ - B5A C11 H16 N6 c1c2c(ncnc....
168 3I7C ic50 = 0.018 uM BK2 C19 H19 N5 CC(C)(C)n1....
169 3V5T - UW9 C24 H30 N6 O CCOc1ccc2c....
170 3N51 - BK3 C22 H24 N6 c1ccc2c(c1....
171 5OTO - AQW C24 H23 Cl2 N3 CCc1ccccc1....
172 3AT4 Kd = 2.26 nM CCK C20 H20 N6 O2 CC(C)Nc1cc....
173 3OWJ Ki = 0.86 uM 1EL C17 H14 N2 O2 Cc1c2c(c(c....
174 6EII - B5W C22 H23 Cl N c1ccc(cc1)....
175 5CU0 - 54R C18 H21 Cl N2 O CC(=O)NCCC....
176 5H8E ic50 < 0.003 uM 5Y3 C21 H25 N9 O CC(=O)Nc1c....
177 5OWH - B0K C10 H9 Br4 N3 c1nc2c(n1C....
178 3WAR - NIO C6 H5 N O2 c1cc(cnc1)....
179 5MOE Kd = 500 uM OQC C11 H10 Cl N O c1cc(c(cc1....
180 5OUE - AVZ C18 H19 Cl N3 c1ccc(cc1)....
181 5MOD Kd = 300 uM 86L C10 H14 Cl N O CC(C)Oc1cc....
182 5OWL - B0K C10 H9 Br4 N3 c1nc2c(n1C....
183 5CU3 Kd = 0.32 uM 54S C26 H26 Cl N3 O4 c1ccc(cc1)....
184 5OTR - AU8 C13 H12 Cl2 N c1ccc(cc1)....
185 4KWP Ki = 0.04 uM EXX C12 H10 Br4 N2 O3 c1nc2c(n1[....
186 5OSL - A9K C13 H12 Cl N O c1ccc(c(c1....
187 5N9N Ki = 0.4 nM KC5 C20 H15 Cl2 N O4 COc1ccc(cc....
188 5CSP Kd = 58 uM 54G C8 H8 O3 Cc1ccc(c(c....
189 5CTP - 54R C18 H21 Cl N2 O CC(=O)NCCC....
190 5MOW - BR9 C5 H6 Br N3 c1c(cnc(c1....
191 4UB7 Ki = 2.5 nM 3G5 C16 H8 Br2 O5 c1cc(ccc1C....
192 5MMF - JMB C16 H19 Cl N CCC[NH2+]C....
193 5OTH - AQ8 C25 H26 Cl N3 O CCc1ccccc1....
194 1PJK - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
195 3NSZ - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
196 5OTI - AOK C25 H26 Cl N3 CCc1ccccc1....
197 3AXW - TID C9 H7 N3 O2 S c1cc(ccc1c....
198 5MO6 - KXZ C19 H21 Cl N2 O3 c1ccc(cc1)....
199 2PVR - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
200 3C13 - EMO C15 H10 O5 Cc1cc2c(c(....
201 5CS6 Kd = 630 uM K82 C10 H14 Cl N O CCCOc1ccc(....
202 3PE2 Ki = 0.175 nM E1B C20 H12 N4 O2 C#Cc1cccc(....
203 5CT0 - 54P C16 H18 Cl N O c1ccc(cc1)....
204 5CU6 - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
205 5M4C - 7EY C16 H14 N2 O2 S2 Cc1ccc(cc1....
206 5MO7 - YRA C16 H17 Cl N2 O c1ccc(cc1)....
207 5N9L Ki = 15 nM 8QH C20 H15 Cl2 N O3 Cc1ccc(cc1....
208 5OT5 - AWK C25 H26 Cl N3 CCc1ccccc1....
209 3OWK ic50 = 1.5 uM 18E C16 H11 Cl N2 O Cc1cnc(c2c....
210 5MMR - H83 C17 H21 Cl N2 c1ccc(cc1)....
211 5MPJ - J2P C15 H17 Cl N CC[NH2+]Cc....
212 5OQU - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
213 6GIH - EZN C15 H13 Cl N2 c1cc(c2cc[....
214 5CSV - GAB C7 H7 N O2 c1cc(cc(c1....
215 5MOT - HBD C7 H7 N O2 c1cc(ccc1C....
216 3R0T ic50 = 0.91 nM FU9 C22 H16 F3 N5 O2 c1cc(cc(c1....
217 3PE1 Ki = 0.38 nM 3NG C19 H12 Cl N3 O2 c1cc(cc(c1....
218 3JUH - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
219 5CLP - 42J C8 H9 Cl2 N c1cc(c(cc1....
220 5ORH Kd = 41 uM A4N C14 H14 Cl N Cc1ccccc1c....
221 3H30 Ki = 29.2 uM RFZ C12 H12 Cl2 N2 O4 c1c2c(cc(c....
222 2ZJW ic50 = 0.04 uM REF C14 H6 O8 c1c2c-3c(c....
223 5OSZ - AHK C24 H25 Cl N3 CCc1ccccc1....
224 4GRB ic50 = 17 nM 0XG C19 H18 N4 O4 S CN(C)C(=O)....
225 5OT6 - AJK C19 H20 Cl N2 c1ccc(cc1)....
226 6EHK - AUW C24 H23 Cl2 N3 CCc1ccccc1....
227 3MB7 ic50 = 200 nM 14I C16 H8 O6 c1cc2c(cc(....
228 5OS8 - J27 C14 H14 Cl F N Cc1cc(ccc1....
229 5OTY - AUW C24 H23 Cl2 N3 CCc1ccccc1....
230 5OTD - AOW C24 H24 Cl N4 O2 CCc1ccccc1....
231 6GMD - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
232 5CVF - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
233 5CX9 - 551 C20 H23 Cl N2 O3 COC(=O)CC(....
234 5OUL - AWE C13 H11 Cl F N c1cc(cc(c1....
235 3SHE - I85 C24 H22 F3 N5 O2 c1cc(cc(c1....
236 5IZJ - 6J9 C10 H13 N5 c1c[nH]c2c....
237 3AG9 Ki = 9 nM A02 C40 H70 N18 O9 [H]/N=C(N)....
238 5IZF Kd = 1.7 nM 6J9 AZ1 DAR ACA DAR NH2 n/a n/a
239 2VZ6 - FEF C20 H19 N3 O4 c1ccc2c(c1....
240 2Z7R ic50 = 3 nM STU C28 H26 N4 O3 C[C@@]12[C....
241 4J8M ic50 = 48 nM CJ5 C26 H25 F3 N8 O c1cc(cc(c1....
242 5ORO - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
243 5OS4 Kd = 1665 uM A8H C14 H15 N O2 c1ccc(cc1)....
244 6HJJ ic50 = 1.7 uM G7T C26 H24 F4 N6 O2 Cc1cc(ccc1....
245 5ORS - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
246 5ORL - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
247 5DR9 - 5E2 C16 H9 Br Cl N O2 c1cc(cc(c1....
248 4DEA ic50 = 256 nM NHI C18 H14 N4 O4 c1cc(ccc1C....
249 5DN3 Kd = 3.77 uM 5DN C16 H9 Br F N O2 c1cc(cc(c1....
250 5ORP - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
251 4DEE - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
252 5OSE Kd = 681 uM A98 C6 H9 N3 O2 S2 CCSc1nnc(s....
253 5DNR - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
254 3UOD Kd = 49 nM 0C3 C18 H13 F3 N4 O2 c1ccc(c(c1....
255 3EFW - AK8 C25 H21 F3 N6 O2 Cc1cc(ccc1....
256 5DT0 - SKE C15 H12 F2 N6 O3 S c1cc(c(c(c....
257 3UO4 Kd = 299 nM 0C0 C23 H18 N4 O2 c1ccc(cc1)....
258 3UP2 Kd = 40 nM 0C8 C18 H13 F3 N4 O3 c1ccc(c(c1....
259 5ORX ic50 = 308 uM A6H C11 H8 Cl2 N2 O c1cc(c(c(c....
260 5ORN - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
261 5OS5 ic50 = 108 uM A8K C12 H10 O2 S c1cc(ccc1O....
262 5DR2 - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
263 3DJ5 - AK5 C21 H20 Br N5 O3 S COc1ccc(cc....
264 3UOL ic50 = 3.1 nM 0C7 C17 H13 Cl N8 c1ccc(c(c1....
265 3D14 ic50 = 22 nM AK1 C19 H15 F3 N6 O S2 c1cc(cc(c1....
266 5OSD - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
267 5OS2 Kd = 1821 uM A7K C13 H21 N2 O c1ccc(c(c1....
268 4BN1 - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
269 2NP8 ic50 = 42 nM CC3 C21 H18 F3 N5 O c1cc(cc(c1....
270 5ORR ic50 = 899 uM A5Q C9 H6 F3 N3 S c1cc(ccc1c....
271 4JBQ - VX6 C23 H28 N8 O S Cc1cc([nH]....
272 5OS3 - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
273 5DRD - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
274 5DPV - SKE C15 H12 F2 N6 O3 S c1cc(c(c(c....
275 5ORZ ic50 = 245 uM A6W C10 H9 N O2 S2 COC(=O)c1c....
276 4UYN ic50 = 2 nM Y3M C25 H22 N4 O4 S CCOC(=O)c1....
277 5DT3 - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
278 2WTV Ki = 1.8 nM ZZL C25 H15 Cl F2 N4 O2 c1cc(c(c(c....
279 6HJK ic50 = 25 nM G7W C25 H20 F4 N6 O2 CC(C)n1c2c....
280 3O50 - LJE C24 H17 F3 N4 O2 Cc1cc(ccc1....
281 2J4Z ic50 = 65 nM 626 C23 H24 N6 O2 S CN1CCN(CC1....
282 3LAU ic50 = 0.044 uM OFI C17 H17 N3 O2 CCCC(=O)Nc....
283 3DAJ ic50 = 2.9 uM FXG C22 H29 N7 O2 CCCCNC(=O)....
284 4JBO ic50 = 24 nM WPH C31 H32 N6 O3 CN(C)CCOc1....
285 5ORW Kd = 796 uM A6E C13 H16 F N O2 S c1cc(ccc1O....
286 2C6D - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
287 5OS0 Kd = 2792 uM A6Z C12 H15 Cl N3 c1cc(cc(c1....
288 3K5U ic50 = 309 nM PFQ C20 H17 N3 O2 c1ccc(cc1)....
289 4KS7 - X4Z C25 H28 N8 O S Cc1nc2ccsc....
290 4DGN ic50 = 0.35 uM LU2 C15 H10 O6 c1cc(c(cc1....
291 1M2Q - MNX C13 H7 N O6 c1cc(c2c(c....
292 2OXY - K17 C7 H2 Br4 N2 c1[nH]c2c(....
293 1M2R - MNY C14 H10 N2 O4 c1cc(c2c(c....
294 3KXN - K8X C7 H2 I4 N2 c1[nH]c2c(....
295 1ZOE Ki = 0.04 uM K25 C9 H7 Br4 N3 CN(C)c1[nH....
296 2PVL Ki = 0.024 uM P55 C18 H20 N8 CCN1CCN(CC....
297 1LP4 - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
298 2PVN Ki = 0.00035 uM P63 C20 H16 N8 O CC(=O)Nc1c....
299 3KXG - K6X C7 H Br5 N2 c12c(c(c(c....
300 3BE9 Ki = 24 nM P04 C19 H21 N7 O c1cc2cc(c1....
301 2OXX - K22 C7 H2 Br4 N2 S c12c(c(c(c....
302 3KXM - K74 C11 H9 Br4 N3 O S CNC(=O)CSc....
303 1LR4 - BEN C7 H8 N2 [H]/N=C(c1....
304 1OM1 Ki = 0.17 uM IQA C17 H12 N2 O3 c1ccc2c(c1....
305 1ZOH Ki = 0.1 uM K44 C10 H7 Br4 N3 C[N@@]1CCn....
306 2PVK Ki = 0.008 uM P45 C19 H14 Cl N7 c1ccc(cc1)....
307 1DAY - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
308 3EH9 - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
309 1IG1 - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
310 5AUW ic50 = 8.9 uM QUE C15 H10 O7 c1cc(c(cc1....
311 5AV2 - KMP C15 H10 O6 c1cc(ccc1C....
312 5AUU ic50 = 21 uM LU2 C15 H10 O6 c1cc(c(cc1....
313 3EHA - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
314 5AV3 - KMP C15 H10 O6 c1cc(ccc1C....
315 5AUT Kd = 6.7 uM 2AN C16 H13 N O3 S c1ccc(cc1)....
316 5AV0 ic50 = 280 uM 47X C15 H10 O5 c1cc(c(cc1....
317 1JKK - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
318 3F5U - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
319 5AV4 - GEN C15 H10 O5 c1cc(ccc1C....
320 5AUX ic50 = 10 uM KMP C15 H10 O6 c1cc(ccc1C....
321 5AUV ic50 = 31 uM AGI C15 H10 O5 c1cc(ccc1C....
322 2XK6 - EQH C18 H21 N3 O2 S c1csc(c1C2....
323 2W5A - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
324 5M55 ic50 = 0.24 uM 7GG C17 H20 N6 CCN(CC)/C=....
325 2XNM ic50 = 0.16 uM WGZ C27 H27 F3 N4 O3 S C[C@H](c1c....
326 2XKF ic50 = 0.87 uM BX1 C19 H24 N4 O5 COc1cc(cc(....
327 2JAV ic50 ~ 8 uM 5Z5 C17 H16 Cl N3 O2 Cc1c([nH]c....
328 5M53 ic50 = 0.62 uM 7GJ C21 H26 N6 O2 CN(C)C(=O)....
329 2XK8 ic50 = 2.4 uM 5R1 C21 H21 N3 O6 COc1cc(ccc....
330 2WQO - VGK C21 H20 N2 O5 COc1cc(cc(....
331 2XKE ic50 = 4.2 uM WI2 C17 H20 N4 O3 COc1cccc(c....
332 2XNN - 430 C21 H16 F3 N3 O2 S C[C@H](c1c....
333 2XK7 ic50 = 1.5 uM 30E C21 H28 N4 O5 CC[C@H]1C[....
334 1Z5M ic50 = 30 nM LI8 C23 H31 Br N8 O3 CC(C)(C(=O....
335 5HKM ic50 = 0.013 uM 61Y C16 H15 N7 CCc1cc(nc(....
336 3QD0 ic50 = 0.00000001 M 3Q4 C24 H26 N8 O C[C@@H]1CC....
337 3ORZ - BI4 C27 H26 N4 O2 C[N@]1CCC[....
338 5LVN Kd = 20 uM ADN C10 H13 N5 O4 c1nc(c2c(n....
339 2XCH ic50 = 374 nM CKG C22 H25 N7 O c1c2c(nc(n....
340 4AW0 - MJF C18 H15 Cl O5 c1ccc(cc1)....
341 3OTU - BI4 C27 H26 N4 O2 C[N@]1CCC[....
342 3QCX ic50 = 0.00000001 M 3Q2 C16 H19 N7 O C[C@@H]1CO....
343 1UU3 ic50 = 0.75 uM LY4 C28 H28 N4 O3 CN(C)C[C@@....
344 5LVL Kd = 1.25 uM 537 C14 H8 N2 O c1ccc2c(c1....
345 3QC4 ic50 = 0.002 uM MP7 C28 H22 F2 N4 O4 c1ccc(cc1)....
346 3QCY ic50 = 0.00000001 M 3Q3 C22 H22 N8 O2 c1ccc(cc1)....
347 1UU8 ic50 = 9 uM BI1 C25 H24 N4 O2 CN(C)CCCn1....
348 4CT1 - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
349 4A07 - AZ7 C17 H13 Cl3 N2 O2 c1cc(ccc1[....
350 2X39 ic50 = 30 nM X39 C19 H21 Cl N6 O c1cc(ccc1C....
351 3E87 - GLY ARG PRO ARG THR THR SER PHE ALA GLU n/a n/a
352 4QNA ic50 = 0.023 uM X11 C9 H9 N5 O c1ccc(c(c1....
353 4QMO ic50 = 0.019 uM 34L C13 H8 N4 O S c1cc2c(c3c....
354 4QMW ic50 = 0.086 uM KS1 C17 H17 N7 c1c[nH]c2c....
355 3A7H - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
356 4QML - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
357 4QO9 ic50 = 0.16 uM 627 C26 H30 N6 O3 CN1CCN(CC1....
358 4QMQ ic50 = 0.26 uM 34U C24 H27 N5 O2 COCCOc1ccc....
359 4EL9 - AFE C21 H20 O10 C[C@H]1[C@....
360 5D9L ic50 = 0.024 uM 583 C15 H12 N2 O2 c1cc(ccc1c....
361 2XK9 ic50 = 0.03 nM XK9 C18 H17 N7 O4 C/C(=NNC(=....
362 2YCS ic50 = 1.36 nM NXP C18 H18 N6 O C/C(=NNC(=....
363 2WTI ic50 = 0.092 uM WTI C18 H15 N3 O3 S c1cc(ccc1c....
364 2YIR ic50 = 0.17 nM YIR C20 H19 N7 O3 [H]/N=C(N)....
365 2XBJ ic50 = 0.86 uM XBJ C23 H27 F N4 O4 CC(C)([C@@....
366 2XM9 ic50 = 0.009 uM LWH C21 H20 N6 O c1ccc2c(c1....
367 2YIQ ic50 = 12.67 nM YIQ C20 H19 N7 O C/C(=NNC(=....
368 2CN5 - ADP C10 H15 N5 O10 P2 c1nc(c2c(n....
369 3HZT - J60 C22 H27 Cl N4 O2 CCN(CC)CCN....
370 4FG8 - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
371 5L2S - 6ZV C27 H32 F2 N8 CCN1CCN(CC....
372 4AUA ic50 = 7.2 uM 4AU C12 H9 N3 O c1ccc2c(c1....
373 5K00 ic50 = 7.1 nM 6PV C32 H34 N6 O4 COc1cccc(c....
374 5MAG - 7KC C25 H30 N8 O S Cc1nc2ccsc....
375 5IHC ic50 = 0.013 uM 6BB C20 H21 F N4 O c1ccc(c(c1....
376 6BUU - GLY ARG PRO ARG THR THR ZXW PHE ALA GLU n/a n/a
377 3QKM ic50 = 0.038 uM SM9 C31 H43 N5 O4 S CCOCCN(C[C....
378 3CQU ic50 = 151 nM CQU C15 H13 N7 Cc1[nH]c(n....
379 2WEI ic50 = 3.4 nM VGG C17 H21 N5 Cc1cccc(c1....
380 3C0G - 3AM C10 H14 N5 O7 P c1nc(c2c(n....
381 3MFR - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
382 4OTI ic50 = 43 nM MI1 C16 H20 N6 O C[C@@H]1CC....
383 3OFM - 4B0 C9 H7 Br4 N3 O C(Cn1c2c(c....
384 5YF9 - NIO C6 H5 N O2 c1cc(cnc1)....
385 5ONI - 9YE C23 H25 N O3 CC(C)n1c2c....
386 3WF7 ic50 = 206 nM FS9 C18 H17 F3 N6 O c1cc(cc(c1....
387 4L3J - 5FI C19 H21 F3 N6 CCc1cncnc1....
388 3WF6 ic50 = 33 nM FZ9 C18 H16 N6 c1ccc2c(c1....
389 4AU8 ic50 = 551 nM Z3R C11 H8 N2 O2 S3 c1ccc2c(c1....
390 6B16 Ki = 32 nM C7Y C19 H20 N8 C[C@@H](c1....
391 5DFP Ki = 22 nM 59U C28 H32 Cl N7 O CCN1c2c(cn....
392 3FXZ ic50 = 130 nM FLL C30 H18 Cl F N5 O4 Ru c1ccc(cc1)....
393 5IME Ki = 4.6 nM 6BZ C22 H22 Cl N7 O2 CC1=NC=CN(....
394 4ZY6 Ki = 5 nM 4T6 C18 H17 Cl N8 c1cc2c(c(c....
395 3Q53 - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
396 4EQC ic50 = 0.008 uM XR1 C29 H28 Cl N7 O S CCN1c2c(cn....
397 5JZJ - AN2 C10 H16 N6 O9 P2 c1nc(c2c(n....
398 5AX9 ic50 = 8 nM 4KT C24 H24 N4 O3 COc1ccc(cc....
399 2J7T - 274 C28 H30 Cl N5 O4 S Cc1c([nH]c....
400 4JQE - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
401 4MWH - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
402 4LFI - GNP C10 H17 N6 O13 P3 c1nc2c(n1[....
403 3GGF - GVD C22 H19 N7 c1ccc2c(c1....
404 4U44 ic50 = 0.008 uM 3D9 C17 H13 N5 c1ccc(cc1)....
405 3DAK - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
406 1QL6 - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
407 1PHK - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
408 3M2W ic50 < 0.003 uM L8I C23 H21 F N4 O CN1CC2(C1)....
409 3BHY - 7CP C18 H18 Cl2 N4 O Cn1c2c(ccc....
410 2J90 - IZA C18 H16 F N3 O CC(C)(C)c1....
411 5VJA - DUK C14 H12 Cl N5 O2 S C[C@H](C(=....
412 5A6N ic50 = 2.1 uM U7E C7 H7 N5 O2 S c1cc(cc(c1....
413 6CMJ ic50 = 5 nM F6J C24 H22 N2 O2 CC(C)Cc1cc....
414 2VN9 - GVD C22 H19 N7 c1ccc2c(c1....
415 4EJN ic50 = 0.005 uM 0R4 C33 H26 F N7 O2 CC(=O)Nc1c....
416 4WNO ic50 = 160 nM 3RF C20 H19 N7 c1ccc2c(c1....
417 4WNP ic50 = 8 nM 3RJ C22 H20 N8 c1ccc2c(c1....
418 5CI7 ic50 = 120 nM 51W C18 H24 I N7 O c1cc(cc(c1....
419 2V7O - DRN C25 H23 N5 O2 S [H]/N=C(/N....
420 3AQV - TAK C24 H25 N5 O c1cc(ccc1c....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: BK3; Similar ligands found: 4
No: Ligand ECFP6 Tc MDL keys Tc
1 BK3 1 1
2 BK1 0.545455 0.75
3 BK6 0.424528 0.844828
4 C88 0.407767 0.803279
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3IGO; Ligand: ANP; Similar sites found with APoc: 497
This union binding pocket(no: 1) in the query (biounit: 3igo.bio1) has 23 residues
No: Leader PDB Ligand Sequence Similarity
1 2F2H XTG 1.02881
2 2HZQ STR 1.14943
3 1IGW PYR 1.15207
4 1IOW PHY 1.30719
5 1IOW ADP 1.30719
6 2VPQ ANP 1.33038
7 3OPT AKG 1.60858
8 5C1P ADP 1.63399
9 5C1P DAL DAL 1.63399
10 4RD0 GDP 1.68675
11 2VQD AP2 1.72414
12 2RJH DCS 1.84697
13 4ZA8 4LU 1.85185
14 4ZA8 FZZ 1.85185
15 4ZA8 F5C 1.85185
16 1EHI ADP 1.85676
17 5NM7 GLY 1.8797
18 2HGS ADP 1.89873
19 2Q8E OGA 1.98864
20 2P5B OGA 1.98864
21 2PUL ACP 2.01511
22 3OV6 MK0 2.01511
23 3D91 REM 2.05279
24 4UWH JXM 2.05761
25 5DZT AMP 2.05761
26 3KAL ADP 2.05761
27 4PAB THG 2.05761
28 5X1M THG 2.1097
29 1NE6 SP1 2.12014
30 1F52 ADP 2.13675
31 2IF8 ADP 2.20386
32 4LIT AKG 2.2113
33 6GN6 GLC 2.23714
34 2IO8 ADP 2.26337
35 4WOE 3S5 2.26337
36 4WOE ADP 2.26337
37 4R78 AMP 2.26537
38 3DNT ATP 2.27273
39 3TM0 ANP 2.28137
40 3TM0 B31 2.28137
41 4CYI ATP 2.28311
42 5YJS SAL 2.30769
43 3WO0 ADP 2.34043
44 3WO0 ALA 2.34043
45 4NTO 1PW 2.41546
46 4NZN ANP 2.42424
47 4NZN 2OU 2.42424
48 5MRH Q9Z 2.46914
49 2R5V HHH 2.52101
50 4C5N ACP 2.53623
51 4LUT DCS 2.5974
52 5CPR 539 2.61194
53 1VRP ADP 2.62467
54 1C3X 8IG 2.63158
55 1J3R 6PG 2.63158
56 2V58 LZJ 2.67261
57 3UDZ ADP 2.6749
58 4RF7 ARG 2.6749
59 3NB0 G6P 2.6749
60 1Z2P ACP 2.77778
61 1Z2P I3S 2.77778
62 2VD9 IN5 2.8133
63 2VD9 EPC 2.8133
64 3W0O ADP 2.86533
65 3W0O HY0 2.86533
66 3BOF HCS 2.88066
67 1Q8A HCS 2.88066
68 5DQ8 FLF 2.91667
69 4ZS4 ATP 2.9316
70 5ZCT ANP 2.94118
71 5GZ9 ANP 2.95082
72 4ITU NAI 2.97398
73 1PK8 ATP 3.08057
74 5IM3 DTP 3.08642
75 6BXL SAM 3.1746
76 5HV7 RBL 3.21101
77 4RDL FUC GAL NDG FUC 3.24675
78 4USI AKG 3.24675
79 3OF1 CMP 3.25203
80 3PDT ADP 3.27273
81 1M0W ANP 3.29218
82 4AVB CMP 3.3033
83 3SHR CMP 3.34448
84 3NOJ PYR 3.36134
85 3WG3 A2G GAL NAG FUC 3.37079
86 4OYA 1VE 3.40426
87 4DFU QUE 3.41615
88 2EV9 SKM 3.42205
89 3ORQ ADP 3.44828
90 4KVL PLM 3.49794
91 1OFZ FUL 3.52564
92 2BKK ADP 3.5503
93 2J0B UDP 3.57143
94 5MW8 ATP 3.60934
95 1CKN GTP 3.63636
96 5Z5I XYP 3.7037
97 3SAO DBH 3.75
98 2YRX AMP 3.7694
99 1I7L ATP 3.8835
100 1Q19 SSC 3.90947
101 5ML3 DL3 4.02685
102 1MJT ITU 4.03458
103 1GSA ADP 4.11392
104 3V4S ADP 4.13437
105 3V4S ATP 4.13437
106 4CS9 AMP 4.2328
107 3VOT ADP 4.23529
108 5XQW 8EU 4.2654
109 4P25 FUC GAL NAG FUC 4.30464
110 1ONI BEZ 4.34783
111 1NIU DCS 4.38144
112 5U7W ADE 4.46009
113 5EQY 5RA 4.48878
114 4NS0 PIO 4.51128
115 1I1E DM2 4.52675
116 1P0Z FLC 4.58015
117 6CGD AKN 4.59016
118 6CGD GNP 4.59016
119 3NZ1 3NY 4.5977
120 1ULE GLA GAL NAG 4.66667
121 6FL8 ADP 4.68085
122 6FL8 TIY 4.68085
123 2OS2 OGA 4.72441
124 2YBP 2HG 4.72441
125 4U98 ACP 4.73251
126 2CFM AMP 4.73251
127 5A5W GUO 4.74308
128 5OCG 9R5 4.7619
129 1OBD ATP 4.90196
130 6C1S EFV 4.93827
131 5LXB 7A9 4.95868
132 1U6R ADP 5
133 2QK4 ATP 5.0885
134 2HK9 SKM 5.09091
135 1KYQ NAD 5.10949
136 6FA4 D1W 5.20231
137 3TDV GDP 5.22876
138 2PYW ADP 5.2381
139 3TII ANP 5.26316
140 4JLS 3ZE 5.26316
141 3I0O ADP 5.30973
142 1IA9 ANP 5.35714
143 3WVR AMP 5.36913
144 1TZD ADP 5.45455
145 5C4L 4XR 5.60748
146 5C4L SIS 5.60748
147 5W75 SUC 5.61225
148 3PN1 IVH 5.66038
149 3HAV ATP 5.68562
150 4X6F 3XU 5.71429
151 5F6U 5VK 5.73248
152 4OCJ NDG 5.80475
153 3X01 AMP 5.85242
154 1FWV SGA MAG FUC 5.97015
155 4OCV ANP 6.0686
156 1E4E ADP 6.12245
157 4N9I PCG 6.19048
158 1ZTH ADP 6.20155
159 1ZP9 ATP 6.20155
160 2BO4 FLC 6.29723
161 2GQS ADP 6.32911
162 2GQR ADP 6.32911
163 1QKQ MAN 6.33803
164 6DZN AE3 6.57277
165 3KIF GDL 6.60377
166 2W5P CL8 6.71141
167 1NJJ GET 6.82353
168 1UYY BGC BGC 6.87023
169 2GC0 PAN 6.91489
170 5C8W PCG 6.99301
171 4GYI ADP 7.0529
172 3AKK ADP 7.07692
173 4M1U A2G MBG 7.14286
174 4Y24 TD2 7.14286
175 1Z0N BCD 7.29167
176 5VZ0 ADP 7.40741
177 5K2M ADP 7.54717
178 3KDM TES 7.55556
179 2PTM CMP 7.57576
180 5A96 GTP 7.63052
181 3KCC CMP 7.69231
182 4YEF 4CQ 7.86517
183 3ZJX BOG 7.95848
184 2AQX ATP 7.95848
185 5KJW 53C 7.96253
186 1Z44 FMN 7.98817
187 1Z42 FMN 7.98817
188 1WAP TRP 8
189 4K55 H6P 8.06452
190 1QAW TRP 8.10811
191 1YRO UDP 8.13008
192 3CQO FUC 8.19113
193 3OYW TDG 8.20895
194 1W6P NDG GAL 8.20895
195 2QL9 CIT 8.24742
196 3K5I ADP 8.43672
197 3K5I AIR 8.43672
198 5CKW ANP 8.64745
199 5KJZ PCG 8.66667
200 1NXJ TLA 8.74317
201 5AE9 OKO 8.84774
202 6GNO XDI 8.88889
203 1SDW IYT 8.9172
204 6AC9 ANP 8.91892
205 6G34 5ID 8.96359
206 4OUC 5ID 8.96359
207 1AUX AGS 9.00322
208 3E7S AT2 9.04872
209 5YK1 ANP 9.0708
210 2XG5 EC5 9.17431
211 2XG5 EC2 9.17431
212 3ZZS TRP 9.23077
213 3RE4 TO1 9.30233
214 2YW2 ATP 9.46502
215 5I35 ANP 9.66921
216 43CA NPO 9.73451
217 2P7Q GG6 9.77444
218 4FE2 ADP 9.80392
219 3F5A SIA GAL NAG 10.1626
220 5TBM 79A 10.2564
221 3ETH ATP 10.4225
222 1TQP ATP 10.6383
223 4O1P ANP 10.6996
224 5OES ADP 10.766
225 5VNF VAL THR SER VAL VAL 10.828
226 5U98 1KX 10.8303
227 5EVY SAL 11.1872
228 1HBK MYR 11.236
229 3VPB ADP 11.3475
230 3VPC ADP 11.3475
231 3ITA AIC 11.3636
232 5HCF BGC 11.4391
233 3VPD ANP 11.7438
234 4XZ3 ACP 13.0435
235 4XYM A12 13.4783
236 4LRJ ANP 13.6095
237 4XH0 ADP 13.6476
238 4WJT NAG 14.3713
239 1GT4 UNA 14.4654
240 3Q60 ATP 14.8248
241 4IX4 ADP 14.8571
242 4AZW ATP 15.0743
243 4OAV ACP 15.4321
244 4O4F ATP 15.7258
245 4O4F IHP 15.7258
246 1W2D ADP 16.6038
247 1W2D 4IP 16.6038
248 4Q5H ANP 18.4211
249 3OCP CMP 18.705
250 2JAP J01 20.2429
251 3VHE 42Q 21.4485
252 4FL3 ANP 21.8107
253 3PVW QRX 21.8107
254 5UKL SIX 21.8107
255 4Y93 746 22.1973
256 4PNI KQQ 22.2222
257 4L9I 8PR 22.2222
258 2PZI AXX 22.2222
259 1OPK P16 24.4856
260 2H8H H8H 24.8971
261 4NFN 2KC 24.9191
262 5DMZ ADP 25.2055
263 5YRJ BGC GLC 25.3521
264 3VRY B43 25.7709
265 3GNI ATP 26.7352
266 6GZD LCI 26.738
267 1Y57 MPZ 26.7699
268 5W4W 9WG 26.8882
269 4KBA 1QM 26.8882
270 4WNK 453 26.9547
271 4WOV 3SM 27.1293
272 2RIO ADP 27.1889
273 5T8O 76Z 27.2206
274 6BFN DL1 27.7778
275 4G17 0VN 27.8788
276 5LPZ ADP 28.012
277 5OKT 9XK 28.3439
278 4WW7 AMP 28.3525
279 4E93 GUI 28.382
280 3UIM ANP 28.5276
281 4F9C 0SX 28.5319
282 4Y0X ADP 28.8
283 2JLD AG1 29.0476
284 3TTI KBI 29.7414
285 4JR7 GNP 29.9465
286 4DC2 ADE 30.0505
287 4IJP 1EH 30.1676
288 4P5Z Q7M 30.4709
289 5C03 AGS 30.7018
290 3E8N ATP 30.7918
291 3E8N VRA 30.7918
292 3H0L ADP 30.8511
293 4OH4 ANP 30.9309
294 5EOB 5QQ 31.0345
295 2R5T ANP 31.0992
296 3LXK MI1 31.1927
297 5LI1 ANP 31.3559
298 6GQM F8H 31.4024
299 5LPB ADP 31.4189
300 4U0I 0LI 31.4286
301 3KRL KRL 31.6418
302 3PP0 03Q 31.6568
303 5LI9 ACP 31.7143
304 2CSN CKI 31.9865
305 5HCY 60D 32.0242
306 6GWR FEW 32.0635
307 4YZC STU 32.0988
308 3V8S 0HD 32.1951
309 5QIN J2V 32.2785
310 4WB7 ATP 32.3457
311 4NM5 ADP 32.3607
312 5Y86 HRM 32.5103
313 5USZ SKE 32.526
314 4E1Z 0MX 32.646
315 3KMW ATP 32.8413
316 4IDT T28 32.8652
317 6F3G CJN 32.8814
318 3ZRM ZRM 32.8841
319 4BTK DTQ 32.9377
320 1VJY 460 33.0033
321 5HVJ ANP 33.0159
322 2F2U M77 33.0846
323 5HES 032 33.2248
324 6A1G 9OL 33.3333
325 1BHX ASP PHE GLU GLU ILE 33.3333
326 5BV6 35G 33.5526
327 5M06 ADP 33.6957
328 4CLI 5P8 33.945
329 4ITH RCM 34.0136
330 5UIU 8CG 34.0557
331 4GJ3 0XP 34.106
332 3LE7 ADE 34.4828
333 3F7Z 34O 34.8571
334 4CRL C1I 34.9754
335 4YMJ 4EJ 35.1974
336 5NKB 8ZT 35.2941
337 5MY8 RXZ 35.5091
338 3LXN MI1 35.5346
339 5WNL STU 35.6725
340 4ASE AV9 35.694
341 1O9U ADZ 35.7143
342 5MJA 7O3 35.7377
343 2XVD AS6 35.7616
344 4WHZ 3NL 35.8442
345 1U5R ATP 35.9195
346 1Q8Y ADE 35.9249
347 1Q8Y ADP 35.9249
348 4UAL 3FV 36.0382
349 1JPA ANP 36.2179
350 2PVF ACP 36.2275
351 5AWM ANP 36.2944
352 2X2M X2M 36.3057
353 3ORK AGS 36.3344
354 5ZTN CUR 36.3636
355 4Y85 499 36.4458
356 5U6C 7YS 36.5079
357 5FBN 5WF 36.5314
358 3SXS PP2 36.5672
359 4I94 ANP 36.6667
360 5TA6 79D 36.8715
361 3MVH WFE 37.1345
362 4WB6 ATP 37.4286
363 4G31 0WH 37.4582
364 2QCS ANP 37.7143
365 5EKO N17 37.7358
366 5KO1 6UY 37.8092
367 4K33 ACP 37.8462
368 5OMY 9YE 37.8517
369 6ES0 BW8 37.8549
370 5VCV 1N1 37.9421
371 5JKG 6LF 37.9421
372 3FHI ANP 38
373 3IDB ANP 38
374 1RE8 BD2 38
375 3PTG 932 38.0165
376 4N70 2HX 38.1098
377 3GQI ACP 38.3436
378 3GC8 B45 38.3784
379 1XJD STU 38.5507
380 2OFV 242 38.6282
381 4XV1 904 38.6986
382 3TXO 07U 38.8102
383 2B9J ADP 38.8102
384 2B9I ADP 38.8102
385 2B9H ADP 38.8102
386 2B9F ADP 38.8102
387 3ALN ANP 38.8379
388 3HMO STU 38.8889
389 1CM8 ANP 38.9646
390 5CEO 50D 39
391 4OTH DRN 39.0029
392 2WU6 DKI 39.1076
393 2JDR L20 39.1813
394 2JDR GLY ARG PRO ARG THR THR SER PHE ALA GLU 39.1813
395 5UPK ANP 39.3064
396 1OUK 084 39.3443
397 3SRV S19 39.3502
398 3FC2 IBI 39.403
399 2GU8 796 39.4659
400 3PLS ANP 39.5973
401 5JFS 6K0 39.6104
402 3CY2 MB9 39.8089
403 4IZY 1J2 39.8374
404 4AG8 AXI 39.8734
405 4LOO SB4 39.8892
406 4F4P 0SB 39.9267
407 1BYG STU 39.9281
408 3RI1 3RH 39.9361
409 5JGA 6KC 40
410 3E7O 35F 40
411 2OO8 RAJ 40.0631
412 3NW7 LGV 40.0651
413 5UR1 YY9 40.1929
414 2Y6O 1N1 40.2062
415 4M69 ANP 40.2827
416 1U59 STU 40.4181
417 5X8I SQZ 40.4624
418 1K3A ACP 40.4682
419 1IR3 ANP 40.5229
420 6BXI ANP 40.5405
421 3DLS ADP 40.597
422 4RFM 3P6 40.6015
423 2WQN ADP 40.6452
424 4CQE CQE 40.6475
425 4UX9 ANP 40.6593
426 6FYL 3NG 40.7714
427 4QTB 38Z 40.7895
428 5LVP ATP 40.836
429 3BU5 ATP 40.8497
430 3H9R TAK 40.9091
431 6FYV 3NG 40.9496
432 4Y8D 49J 41.1765
433 5VC5 96M 41.1765
434 6G33 5ID 41.2979
435 3GC0 AMP 41.3374
436 3EKK GS2 41.3681
437 4H3Q ANP 41.4365
438 3RWP ABQ 41.4791
439 6C0T EE4 41.4986
440 5Y80 IRE 41.5335
441 4X7Q 3YR 41.6667
442 4H3P ANP 41.7127
443 5WO4 B7V 41.7219
444 2YAB AMP 41.8283
445 4EWH T77 42.1818
446 5DRB 5FJ 42.268
447 3G5D 1N1 42.3077
448 6E2O S0L 42.3729
449 5BVE 4VG 42.3823
450 4UXL 5P8 42.5466
451 4NST ADP 42.735
452 5N87 N66 42.8115
453 5DBX ANP 42.9878
454 4I6H 1C8 43.1818
455 5TO8 7FM 43.2624
456 2HK5 1BM 43.3333
457 5EFQ ADP 43.5159
458 4TWP AXI 43.5424
459 4EUU BX7 43.8871
460 6C7Y ADP 44.0559
461 3SLS ANP 44.0789
462 5DH3 5BS 44.127
463 4AT3 LTI 44.1472
464 4YZN 4K5 44.2509
465 4NW6 2NS 44.2724
466 5IH9 6BF 44.4776
467 6GIN IR2 44.5183
468 5H2U 1N1 44.5693
469 6CQF F97 44.7811
470 2QLU ADE 44.9045
471 6CZ3 FLJ 45.0758
472 5DEY 59T 45.1178
473 4QMN DB8 45.1613
474 4BFM ANP 45.2096
475 4BHN BH9 45.2096
476 4USF 6UI 45.7237
477 3TKI S25 45.8204
478 2HY0 306 45.9627
479 5HQ0 LZ9 46.0265
480 6GU6 1QK 46.0265
481 2F57 23D 46.0568
482 1ZY5 ANP 46.5347
483 5EH0 5NW 46.8992
484 4CSV STI 46.9091
485 2BPM 529 47.5728
486 3BZ3 YAM 48.1884
487 2A19 ANP 48.2394
488 4CFU 2WC 48.5149
489 1UNH IXM 48.6301
490 3O0G 3O0 48.6301
491 4BCM T7Z 48.8372
492 4BCQ TJF 48.8372
493 4BCN T9N 49
494 6GUE FB8 49.0066
495 2XMY CDK 49.3289
496 4L3L 5FI 49.3421
497 5LMK 6ZK 49.4949
498 3FHR P4O 50
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