Receptor
PDB id Resolution Class Description Source Keywords
8DFR 1.7 Å EC: 1.5.1.3 REFINED CRYSTAL STRUCTURES OF CHICKEN LIVER DIHYDROFOLATE REDUCTASE. 3 ANGSTROMS APO-ENZYME AND 1.7 ANGSTROMS NADPH H OLO-ENZYME COMPLEX GALLUS GALLUS OXIDOREDUCTASE(CHNH(D)-NAD+ OR NADP+(A))
Ref.: REFINED CRYSTAL STRUCTURES OF CHICKEN LIVER DIHYDROFOLATE REDUCTASE. 3 ANGSTROMS APO-ENZYME AND 1.7 ANGSTROMS NADPH HOLO-ENZYME COMPLEX TO BE PUBLISHED
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
CA A:200;
Part of Protein;
none;
submit data
40.078 Ca [Ca+2...
NDP A:191;
Valid;
none;
submit data
745.421 C21 H30 N7 O17 P3 c1nc(...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1DR1 2.2 Å EC: 1.5.1.3 2.2 ANGSTROMS CRYSTAL STRUCTURE OF CHICKEN LIVER DIHYDROFOLA REDUCTASE COMPLEXED WITH NADP+ AND BIOPTERIN GALLUS GALLUS OXIDOREDUCTASE
Ref.: CRYSTAL STRUCTURE OF CHICKEN LIVER DIHYDROFOLATE RE COMPLEXED WITH NADP+ AND BIOPTERIN. BIOCHEMISTRY V. 31 7264 1992
Members (8)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 28 families.
1 1DR6 - HBI C9 H13 N5 O3 C[C@@H]([C....
2 1DR1 - HBI C9 H13 N5 O3 C[C@@H]([C....
3 1DR3 - HBI C9 H13 N5 O3 C[C@@H]([C....
4 1DR4 - HBI C9 H13 N5 O3 C[C@@H]([C....
5 1DR7 - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
6 1DR2 - TAP C21 H28 N7 O16 P3 S c1cc(c[n+]....
7 1DR5 - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
8 8DFR - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
70% Homology Family (71)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 22 families.
1 2FZJ - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
2 3K47 ic50 = 14.5 uM D09 C16 H16 N4 O2 C/C(=Cc1co....
3 3D80 - Q22 C21 H19 N7 O c1cc2c(cc1....
4 3D84 - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
5 3K45 ic50 = 3.9 uM 51P C16 H16 N4 O2 C/C(=C/c1c....
6 1U70 Ki = 230 nM MTX C20 H22 N8 O5 CN(Cc1cnc2....
7 4QJC ic50 = 0.15 uM IXE C14 H11 F3 N6 CN(c1cc(c(....
8 4QHV - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
9 2C2S ic50 = 0.15 uM 34B C8 H20 B10 N4 [BH]1234[B....
10 1U71 - MXA C17 H19 N5 O2 Cc1c(cnc2c....
11 4G95 Ki = 24.4 nM OAG C14 H12 Cl2 N6 c1cc(c(cc1....
12 1OHJ - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
13 3NZD - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
14 3GHV - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
15 3NXV - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
16 1PD9 - CO4 C19 H24 N6 O3 Cc1c(cnc2c....
17 3NXX Ki = 11 uM D2D C19 H22 N4 O2 CC(C)C/C(=....
18 1DHF Kd = 0.111 uM FOL C19 H19 N7 O6 c1cc(ccc1C....
19 3F8Y Ki = 8.3 nM DH1 C17 H22 N4 O4 COc1ccc(cc....
20 3GYF ic50 = 12.3 nM 51P C16 H16 N4 O2 C/C(=C/c1c....
21 4KFJ ic50 = 60 nM 1R0 C25 H23 N5 O CCc1c(c(nc....
22 3S7A - 684 C25 H23 N7 O3 c1ccc2c(c1....
23 4M6K - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
24 4KAK ic50 = 1300 nM 06U C22 H23 N5 O CCc1c(c(nc....
25 1MVT - DTM C18 H22 N6 O3 CN(Cc1cc(c....
26 1DRF Kd = 0.111 uM FOL C19 H19 N7 O6 c1cc(ccc1C....
27 1PD8 - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
28 1S3V - TQD C19 H29 N5 O3 CN(CC1CCC2....
29 3NXT - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
30 3NU0 ic50 = 0.1 uM 3TU C24 H21 N5 O6 S c1cc(c2c(c....
31 4KEB ic50 = 45 nM 1QZ C26 H25 N5 O CCc1c(c(nc....
32 1BOZ ic50 = 8500 nM PRD C17 H20 N6 O2 C[N@](Cc1c....
33 1DLR Ki = 16.4 nM MXA C17 H19 N5 O2 Cc1c(cnc2c....
34 3GHW Kd = 0.02 uM GHW C19 H18 N4 O6 S2 Cc1c(c2c(s....
35 1HFR Ki = 790 nM MOT C20 H22 N6 O6 C[N@](Cc1c....
36 4M6J - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
37 3F91 - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
38 3NXO Ki = 0.83 uM D2B C18 H20 N4 O2 CC(C)/C(=C....
39 4DDR Ki = 2841 nM MMV C18 H24 N4 O4 CCc1c(c(nc....
40 3NXY - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
41 3F8Z Ki = 66 nM DH1 C17 H22 N4 O4 COc1ccc(cc....
42 3S3V Ki = 593 nM TOP C14 H18 N4 O3 COc1cc(cc(....
43 1U72 Kd = 0.0034 nM MTX C20 H22 N8 O5 CN(Cc1cnc2....
44 4M6L - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
45 1DLS Ki = 10.9 nM MTX C20 H22 N8 O5 CN(Cc1cnc2....
46 1KMV - LII C18 H19 N5 O2 Cc1c(cnc2c....
47 1MVS - DTM C18 H22 N6 O3 CN(Cc1cc(c....
48 4KBN ic50 = 330 nM 25U C19 H18 N6 CCc1c(c(nc....
49 3NXR Ki = 11 uM D2D C19 H22 N4 O2 CC(C)C/C(=....
50 1S3W - TQT C17 H33 N5 C1CCC2C(C1....
51 3NTZ ic50 = 0.09 uM 3TZ C23 H21 N5 O6 S c1cc(c2c(c....
52 3GHC - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
53 1HFP Ki = 1036 nM MOT C20 H22 N6 O6 C[N@](Cc1c....
54 2C2T ic50 = 15 uM 39B C8 H20 B9 N4 [H]1[BH]2[....
55 3GI2 - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
56 2DHF - DZF C20 H20 N6 O6 c1cc(ccc1C....
57 1OHK - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
58 1HFQ Ki = 2.7 nM MOT C20 H22 N6 O6 C[N@](Cc1c....
59 1S3U - TQD C19 H29 N5 O3 CN(CC1CCC2....
60 3N0H Ki = 617 nM TOP C14 H18 N4 O3 COc1cc(cc(....
61 3EIG Ki = 21 nM MTX C20 H22 N8 O5 CN(Cc1cnc2....
62 1KMS - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
63 3FS6 Ki = 230 nM DH1 C17 H22 N4 O4 COc1ccc(cc....
64 1DR6 - HBI C9 H13 N5 O3 C[C@@H]([C....
65 1DR1 - HBI C9 H13 N5 O3 C[C@@H]([C....
66 1DR3 - HBI C9 H13 N5 O3 C[C@@H]([C....
67 1DR4 - HBI C9 H13 N5 O3 C[C@@H]([C....
68 1DR7 - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
69 1DR2 - TAP C21 H28 N7 O16 P3 S c1cc(c[n+]....
70 1DR5 - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
71 8DFR - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
50% Homology Family (233)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 12 families.
1 2FZJ - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
2 3K47 ic50 = 14.5 uM D09 C16 H16 N4 O2 C/C(=Cc1co....
3 3D80 - Q22 C21 H19 N7 O c1cc2c(cc1....
4 3D84 - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
5 3K45 ic50 = 3.9 uM 51P C16 H16 N4 O2 C/C(=C/c1c....
6 1U70 Ki = 230 nM MTX C20 H22 N8 O5 CN(Cc1cnc2....
7 4QJC ic50 = 0.15 uM IXE C14 H11 F3 N6 CN(c1cc(c(....
8 4QHV - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
9 2C2S ic50 = 0.15 uM 34B C8 H20 B10 N4 [BH]1234[B....
10 1U71 - MXA C17 H19 N5 O2 Cc1c(cnc2c....
11 4G95 Ki = 24.4 nM OAG C14 H12 Cl2 N6 c1cc(c(cc1....
12 1OHJ - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
13 3NZD - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
14 3GHV - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
15 3NXV - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
16 1PD9 - CO4 C19 H24 N6 O3 Cc1c(cnc2c....
17 3NXX Ki = 11 uM D2D C19 H22 N4 O2 CC(C)C/C(=....
18 1DHF Kd = 0.111 uM FOL C19 H19 N7 O6 c1cc(ccc1C....
19 3F8Y Ki = 8.3 nM DH1 C17 H22 N4 O4 COc1ccc(cc....
20 3GYF ic50 = 12.3 nM 51P C16 H16 N4 O2 C/C(=C/c1c....
21 4KFJ ic50 = 60 nM 1R0 C25 H23 N5 O CCc1c(c(nc....
22 3S7A - 684 C25 H23 N7 O3 c1ccc2c(c1....
23 4M6K - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
24 4KAK ic50 = 1300 nM 06U C22 H23 N5 O CCc1c(c(nc....
25 1MVT - DTM C18 H22 N6 O3 CN(Cc1cc(c....
26 1DRF Kd = 0.111 uM FOL C19 H19 N7 O6 c1cc(ccc1C....
27 1PD8 - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
28 1S3V - TQD C19 H29 N5 O3 CN(CC1CCC2....
29 3NXT - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
30 3NU0 ic50 = 0.1 uM 3TU C24 H21 N5 O6 S c1cc(c2c(c....
31 4KEB ic50 = 45 nM 1QZ C26 H25 N5 O CCc1c(c(nc....
32 1BOZ ic50 = 8500 nM PRD C17 H20 N6 O2 C[N@](Cc1c....
33 1DLR Ki = 16.4 nM MXA C17 H19 N5 O2 Cc1c(cnc2c....
34 3GHW Kd = 0.02 uM GHW C19 H18 N4 O6 S2 Cc1c(c2c(s....
35 1HFR Ki = 790 nM MOT C20 H22 N6 O6 C[N@](Cc1c....
36 4M6J - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
37 3F91 - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
38 3NXO Ki = 0.83 uM D2B C18 H20 N4 O2 CC(C)/C(=C....
39 4DDR Ki = 2841 nM MMV C18 H24 N4 O4 CCc1c(c(nc....
40 3NXY - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
41 3F8Z Ki = 66 nM DH1 C17 H22 N4 O4 COc1ccc(cc....
42 3S3V Ki = 593 nM TOP C14 H18 N4 O3 COc1cc(cc(....
43 1U72 Kd = 0.0034 nM MTX C20 H22 N8 O5 CN(Cc1cnc2....
44 4M6L - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
45 1DLS Ki = 10.9 nM MTX C20 H22 N8 O5 CN(Cc1cnc2....
46 1KMV - LII C18 H19 N5 O2 Cc1c(cnc2c....
47 1MVS - DTM C18 H22 N6 O3 CN(Cc1cc(c....
48 4KBN ic50 = 330 nM 25U C19 H18 N6 CCc1c(c(nc....
49 3NXR Ki = 11 uM D2D C19 H22 N4 O2 CC(C)C/C(=....
50 1S3W - TQT C17 H33 N5 C1CCC2C(C1....
51 3NTZ ic50 = 0.09 uM 3TZ C23 H21 N5 O6 S c1cc(c2c(c....
52 3GHC - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
53 1HFP Ki = 1036 nM MOT C20 H22 N6 O6 C[N@](Cc1c....
54 2C2T ic50 = 15 uM 39B C8 H20 B9 N4 [H]1[BH]2[....
55 3GI2 - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
56 2DHF - DZF C20 H20 N6 O6 c1cc(ccc1C....
57 1OHK - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
58 1HFQ Ki = 2.7 nM MOT C20 H22 N6 O6 C[N@](Cc1c....
59 1S3U - TQD C19 H29 N5 O3 CN(CC1CCC2....
60 3N0H Ki = 617 nM TOP C14 H18 N4 O3 COc1cc(cc(....
61 3EIG Ki = 21 nM MTX C20 H22 N8 O5 CN(Cc1cnc2....
62 1KMS - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
63 3FS6 Ki = 230 nM DH1 C17 H22 N4 O4 COc1ccc(cc....
64 3FQO ic50 = 0.67 uM N22 C17 H20 N4 O2 CCc1c(c(nc....
65 3SRU Ki = 0.02 nM Q26 C23 H23 N5 O3 S CCOc1ccc(c....
66 3FY9 Ki = 3.5 nM XCF C19 H22 N4 O3 COc1cc(c2c....
67 4LEK Ki = 0.16 nM 1DN C20 H17 N7 O2 S COc1cc2c(c....
68 4TU5 ic50 = 18 nM 06W C22 H23 N5 O CCc1c(c(nc....
69 2W9G Kd = 8.1 nM NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
70 3SRQ Ki = 0.48 nM Q19 C17 H16 N4 O Cc1cc2c(cc....
71 4LAG Ki = 0.011 nM 1VN C20 H16 Cl N7 S Cc1cc2c(cc....
72 3M08 Ki = 2.8 nM RAR C27 H30 N6 O3 CCC[C@H]1c....
73 3FYW Ki = 0.23 nM I2H C19 H22 N4 O3 COc1cc(c2c....
74 3FRD - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
75 3F0Q Ki = 10 nM 52V C24 H26 N4 O Cc1cccc(c1....
76 2W9H Kd = 430 nM TOP C14 H18 N4 O3 COc1cc(cc(....
77 4LAE Ki = 0.002 nM 1VM C20 H17 N7 S Cc1cc2c(cc....
78 3FYV Ki = 0.22 nM XCF C19 H22 N4 O3 COc1cc(c2c....
79 3F0U ic50 = 0.19 uM 53R C22 H22 N4 O Cc1c(c(nc(....
80 3FQ0 ic50 = 0.068 uM N22 C17 H20 N4 O2 CCc1c(c(nc....
81 3FQF ic50 = 0.75 uM 55V C19 H24 N4 O3 Cc1c(c(nc(....
82 3SRS Ki = 0.76 nM M23 C17 H17 Br N4 O CCOc1ccc(c....
83 3F0B ic50 = 0.061 uM 53R C22 H22 N4 O Cc1c(c(nc(....
84 3FRA Ka = 76000000 M^-1 I2H C19 H22 N4 O3 COc1cc(c2c....
85 5ISQ Ki = 158.3 nM U06 C23 H22 N4 O3 CCc1c(c(nc....
86 3FRB Ka = 5800000 M^-1 TOP C14 H18 N4 O3 COc1cc(cc(....
87 3SRR Ki = 0.24 nM Q20 C18 H18 N4 O2 CCOc1ccc(c....
88 5JG0 ic50 = 0.01 uM UC9 C24 H22 N4 O4 CCc1c(c(nc....
89 3FQV ic50 = 0.77 uM 11F C22 H22 N4 O Cc1c(c(nc(....
90 5ISP Ki = 11.75 nM U06 C23 H22 N4 O3 CCc1c(c(nc....
91 4LAH Ki = 0.096 nM 1VO C20 H17 N7 S Cc1cc2c(cc....
92 3SRW Ki = 0.026 nM Q27 C21 H20 N4 O CCOc1ccc2c....
93 3I8A Ki = 0.12 uM N22 C17 H20 N4 O2 CCc1c(c(nc....
94 3M09 Ki = 0.9 nM RAR C27 H30 N6 O3 CCC[C@H]1c....
95 4FGG Ki = 4.1 nM 0U5 C31 H36 N6 O3 CCCc1c(c(n....
96 3FRE Ki = 0.0006 uM TOP C14 H18 N4 O3 COc1cc(cc(....
97 5IST Ki = 3.89 nM U06 C23 H22 N4 O3 CCc1c(c(nc....
98 3FY8 Ki = 0.9 nM I2H C19 H22 N4 O3 COc1cc(c2c....
99 3SR5 Ki = 0.35 nM Q12 C17 H18 N4 O2 Cc1cc2c(cc....
100 1RA9 Kd = 24 uM NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
101 3QYL Ki = 1 uM 7ME C9 H14 N4 C[C@H]1CCc....
102 1RA1 Kd = 24 uM NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
103 1RX6 - DDF C21 H25 N5 O6 c1cc(ccc1C....
104 1JOM - FFO C20 H23 N7 O7 c1cc(ccc1C....
105 2D0K Kd = 9.51 uM FOL C19 H19 N7 O6 c1cc(ccc1C....
106 1DRA - MTX C20 H22 N8 O5 CN(Cc1cnc2....
107 1RC4 - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
108 2ANQ ic50 = 0.075 uM C1A C14 H22 N8 S2 [H]/N=C(/N....
109 4PSY - FOL C19 H19 N7 O6 c1cc(ccc1C....
110 4KJJ - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
111 5CCC - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
112 3QYO Ki = 7 uM Q24 C8 H8 N4 c1ccc2c(c1....
113 6DFR Kd = 24 uM NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
114 4P68 - MTX C20 H22 N8 O5 CN(Cc1cnc2....
115 1RX1 Kd = 24 uM NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
116 1TDR - MTX C20 H22 N8 O5 CN(Cc1cnc2....
117 3OCH - 2MX C49 H62 N18 O8 CN(Cc1cnc2....
118 7DFR - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
119 4PSS - FOL C19 H19 N7 O6 c1cc(ccc1C....
120 2DRC Kd = 0.13 nM MTX C20 H22 N8 O5 CN(Cc1cnc2....
121 3R33 Ki = 0.8 uM 6ME C9 H14 N4 C[C@H]1CCc....
122 1RB3 - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
123 1DHI Kd = 55 nM MTX C20 H22 N8 O5 CN(Cc1cnc2....
124 1DYI - FOL C19 H19 N7 O6 c1cc(ccc1C....
125 1RA2 - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
126 4DFR - MTX C20 H22 N8 O5 CN(Cc1cnc2....
127 4PST - FOL C19 H19 N7 O6 c1cc(ccc1C....
128 3DAU - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
129 4NX7 - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
130 3QL3 - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
131 4PTH - FOL C19 H19 N7 O6 c1cc(ccc1C....
132 4GH8 Kd = 2.6 uM NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
133 4P3R - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
134 3QL0 - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
135 4P66 - MTX C20 H22 N8 O5 CN(Cc1cnc2....
136 1RG7 Kd = 0.7 nM MTX C20 H22 N8 O5 CN(Cc1cnc2....
137 1DDS - MTX C20 H22 N8 O5 CN(Cc1cnc2....
138 1DRH Kd = 24 uM NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
139 4QLF - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
140 1RH3 - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
141 1RA8 - FOL C19 H19 N7 O6 c1cc(ccc1C....
142 1DHJ Kd = 281 nM MTX C20 H22 N8 O5 CN(Cc1cnc2....
143 4PTJ - FOL C19 H19 N7 O6 c1cc(ccc1C....
144 1RX3 - MTX C20 H22 N8 O5 CN(Cc1cnc2....
145 1DYH - DZF C20 H20 N6 O6 c1cc(ccc1C....
146 1RX9 Kd = 24 uM NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
147 3DRC Kd = 0.7 nM MTX C20 H22 N8 O5 CN(Cc1cnc2....
148 1DDR - MTX C20 H22 N8 O5 CN(Cc1cnc2....
149 1JOL - FFO C20 H23 N7 O7 c1cc(ccc1C....
150 1RX4 - DDF C21 H25 N5 O6 c1cc(ccc1C....
151 1RA3 - MTX C20 H22 N8 O5 CN(Cc1cnc2....
152 4P3Q - FOL C19 H19 N7 O6 c1cc(ccc1C....
153 4KJK - FOL C19 H19 N7 O6 c1cc(ccc1C....
154 1RF7 - DHF C19 H21 N7 O6 c1cc(ccc1C....
155 1RX5 - DDF C21 H25 N5 O6 c1cc(ccc1C....
156 4QLE - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
157 1RX2 - FOL C19 H19 N7 O6 c1cc(ccc1C....
158 1RX7 - FOL C19 H19 N7 O6 c1cc(ccc1C....
159 4NX6 - FOL C19 H19 N7 O6 c1cc(ccc1C....
160 1DYJ - DDF C21 H25 N5 O6 c1cc(ccc1C....
161 4KJL - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
162 3IX9 Ki = 3.9 nM MTX C20 H22 N8 O5 CN(Cc1cnc2....
163 3DFR ic50 = 3 nM MTX C20 H22 N8 O5 CN(Cc1cnc2....
164 4H97 ic50 = 22 nM 53S C23 H24 N4 O Cc1ccc(cc1....
165 1M79 ic50 = 320 nM MQ1 C15 H14 N4 O2 COc1ccc(cc....
166 3QLR ic50 = 45 nM QLR C19 H24 N4 O3 CC[C@@H](C....
167 1AOE Ki = 0.22 nM GW3 C15 H19 N5 CCC(CC)n1c....
168 1IA3 ic50 = 8 nM TQ5 C18 H20 N4 S CC(C)(C)c1....
169 4HOF ic50 = 20 nM 18H C22 H22 N4 O Cc1c(c(nc(....
170 3QLW ic50 = 100 nM N22 C17 H20 N4 O2 CCc1c(c(nc....
171 1IA1 ic50 = 0.034 uM TQ3 C14 H12 N4 S c1ccc(cc1)....
172 3QLS ic50 = 33 nM 55V C19 H24 N4 O3 Cc1c(c(nc(....
173 1AI9 - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
174 1IA4 ic50 = 0.13 uM TQ6 C18 H19 N5 O S c1cc2c(c(c....
175 4HOE ic50 = 36 nM 18G C23 H24 N4 O2 Cc1c(c(nc(....
176 1M7A ic50 = 9 nM MQU C15 H19 N5 O2 COCC(COC)n....
177 1M78 ic50 = 52 nM CLZ C8 H8 Cl N5 O2 c1cc2c(c(c....
178 1IA2 ic50 = 0.023 uM TQ4 C15 H14 N4 S Cc1ccc(cc1....
179 3EEL ic50 = 0.55 nM 53T C24 H26 N4 O Cc1cc(cc(c....
180 3QLZ ic50 = 15 nM QLZ C18 H22 N4 O2 CCCc1c(c(n....
181 3EEK ic50 = 0.61 nM 53S C23 H24 N4 O Cc1ccc(cc1....
182 3CSE ic50 = 8.2 nM N22 C17 H20 N4 O2 CCc1c(c(nc....
183 3QLX ic50 = 27 nM QLR C19 H24 N4 O3 CC[C@@H](C....
184 3EEJ ic50 = 7.3 nM 53R C22 H22 N4 O Cc1c(c(nc(....
185 3EEM ic50 = 5.5 nM 53V C24 H26 N4 O Cc1cccc(c1....
186 4HOG ic50 = 5.5 nM 18H C22 H22 N4 O Cc1c(c(nc(....
187 3IA4 - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
188 1DR6 - HBI C9 H13 N5 O3 C[C@@H]([C....
189 1DR1 - HBI C9 H13 N5 O3 C[C@@H]([C....
190 1DR3 - HBI C9 H13 N5 O3 C[C@@H]([C....
191 1DR4 - HBI C9 H13 N5 O3 C[C@@H]([C....
192 1DR7 - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
193 1DR2 - TAP C21 H28 N7 O16 P3 S c1cc(c[n+]....
194 1DR5 - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
195 8DFR - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
196 4ELG Ki = 6.9 nM 52J C28 H32 N6 O3 CC(C)C[C@H....
197 3DAT - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
198 3E0B ic50 = 0.89 uM N22 C17 H20 N4 O2 CCc1c(c(nc....
199 2QK8 ic50 ~ 20 nM MTX C20 H22 N8 O5 CN(Cc1cnc2....
200 4ELE Ki = 13.4 nM 31I C27 H30 N6 O3 CC(C)[C@H]....
201 4ELH Ki = 8.2 nM 53I C28 H30 N6 O3 CC(=C[C@@H....
202 3FL8 ic50 = 54 nM RAR C27 H30 N6 O3 CCC[C@H]1c....
203 4ELF Ki = 9.4 nM 35I C27 H27 F3 N6 O3 COc1cc(cc(....
204 3FL9 ic50 = 77 mM TOP C14 H18 N4 O3 COc1cc(cc(....
205 1S3Y ic50 = 210 nM TQT C17 H33 N5 C1CCC2C(C1....
206 4IXG ic50 = 0.076 uM IXG C14 H14 N6 CN(c1ccccc....
207 2FZH ic50 = 0.049 nM DH1 C17 H22 N4 O4 COc1ccc(cc....
208 4CD2 - FOL C19 H19 N7 O6 c1cc(ccc1C....
209 3NZC - D2O C24 H25 N5 O2 Cc1c(cnc2c....
210 3NZA - D2K C22 H27 N5 O4 CCOC(=O)CC....
211 4G8Z Ki = 227 nM TOP C14 H18 N4 O3 COc1cc(cc(....
212 3NZ6 ic50 = 1.3 nM D2J C22 H27 N5 O4 Cc1c(cnc2c....
213 1CD2 - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
214 3NZB ic50 = 35 nM D2N C24 H31 N5 O4 CCOC(=O)CC....
215 3NZ9 ic50 = 6.5 nM D2K C22 H27 N5 O4 CCOC(=O)CC....
216 1DYR ic50 = 20 uM TOP C14 H18 N4 O3 COc1cc(cc(....
217 3TD8 ic50 = 1.2 nM D2R C22 H23 N5 O3 Cc1c(cnc2c....
218 1LY3 ic50 = 87 nM COG C18 H21 N5 O2 CN(Cc1cc(c....
219 3CD2 - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
220 1VJ3 ic50 = 0.17 uM TAB C23 H26 Cl N7 O2 CCc1c(c(nc....
221 1E26 - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
222 1DAJ Ki = 6.5 nM MOT C20 H22 N6 O6 C[N@](Cc1c....
223 2FZI ic50 = 1 nM DH3 C19 H22 N4 O4 COc1cc(cc(....
224 4IXE - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
225 1KLK ic50 = 0.21 uM PMD C21 H17 N7 c1ccc2c(c1....
226 2CD2 - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
227 4IXF - NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
228 1LY4 ic50 = 76 nM COQ C17 H20 N6 O2 CN(Cc1cc(c....
229 4M7V Ki = 4.5 nM RAR C27 H30 N6 O3 CCC[C@H]1c....
230 4M7U - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
231 2W9S Kd = 2370 nM NDP C21 H30 N7 O17 P3 c1nc(c2c(n....
232 4OR7 ic50 = 23 nM 25U C19 H18 N6 CCc1c(c(nc....
233 5DXV - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: NDP; Similar ligands found: 159
No: Ligand ECFP6 Tc MDL keys Tc
1 NDP 1 1
2 0WD 0.827273 1
3 NAI 0.803738 0.986842
4 NMN AMP PO4 0.794643 0.948052
5 NPW 0.692308 0.962025
6 NZQ 0.686441 0.987013
7 DG1 0.68 1
8 1DG 0.68 1
9 A2R 0.650943 0.909091
10 A22 0.64486 0.934211
11 TXP 0.644628 0.924051
12 ATR 0.640777 0.894737
13 NA7 0.636364 0.886076
14 XNP 0.620968 0.949367
15 AP0 0.598361 0.948718
16 A2P 0.598039 0.881579
17 NJP 0.574803 0.923077
18 25L 0.550847 0.934211
19 ODP 0.550388 0.936709
20 NAX 0.544 0.949367
21 25A 0.53913 0.921053
22 2AM 0.529412 0.87013
23 6V0 0.519685 0.974026
24 NAP 0.514493 0.922078
25 EAD 0.507143 0.949367
26 A2D 0.504673 0.921053
27 TXE 0.503876 0.935897
28 NA0 0.496454 0.910256
29 TXD 0.496124 0.911392
30 SAP 0.495575 0.875
31 AGS 0.495575 0.875
32 P1H 0.493056 0.925926
33 CO7 0.489796 0.791209
34 TAP 0.489362 0.864198
35 PAP 0.482456 0.907895
36 BA3 0.481818 0.921053
37 NAJ PZO 0.478261 0.924051
38 ATP 0.477876 0.921053
39 B4P 0.477477 0.921053
40 ADP 0.477477 0.921053
41 AP5 0.477477 0.921053
42 OAD 0.47541 0.897436
43 5FA 0.473684 0.921053
44 AR6 0.473684 0.896104
45 APR 0.473684 0.896104
46 AQP 0.473684 0.921053
47 AN2 0.473214 0.909091
48 3OD 0.467742 0.897436
49 50T 0.464912 0.884615
50 PO4 PO4 A A A A PO4 0.463415 0.857143
51 V3L 0.461538 0.896104
52 2A5 0.46087 0.85
53 A1R 0.459016 0.841463
54 ADQ 0.459016 0.897436
55 4AD 0.459016 0.875
56 OVE 0.458716 0.8375
57 OMR 0.458647 0.813953
58 PPS 0.457627 0.811765
59 AD9 0.456897 0.897436
60 CA0 0.45614 0.897436
61 M33 0.45614 0.884615
62 ADJ 0.455882 0.879518
63 A3P 0.455357 0.894737
64 ACP 0.452174 0.897436
65 ENP 0.451613 0.85
66 UP5 0.451128 0.948052
67 SRP 0.45 0.8625
68 ANP 0.449153 0.897436
69 ACQ 0.449153 0.897436
70 PRX 0.448276 0.82716
71 5AL 0.445378 0.884615
72 7D4 0.443478 0.8375
73 ADX 0.443478 0.811765
74 AMP 0.436364 0.894737
75 A 0.436364 0.894737
76 4TC 0.433824 0.924051
77 7D3 0.433628 0.8375
78 ETB 0.433566 0.797753
79 DCA 0.433566 0.788889
80 1ZZ 0.433071 0.802326
81 BIS 0.433071 0.864198
82 00A 0.432 0.864198
83 ATF 0.429752 0.886076
84 0T1 0.427586 0.788889
85 5SV 0.427419 0.788235
86 8QN 0.427419 0.884615
87 3AM 0.427273 0.857143
88 N01 0.426573 0.884615
89 PR8 0.425197 0.811765
90 WAQ 0.425197 0.841463
91 LAD 0.425197 0.821429
92 DTP 0.425 0.8375
93 AMO 0.424 0.886076
94 PAJ 0.424 0.843373
95 APC 0.423729 0.886076
96 UPA 0.423358 0.935897
97 48N 0.422222 0.853659
98 FYA 0.421875 0.860759
99 PTJ 0.421875 0.853659
100 CNA 0.421429 0.910256
101 PUA 0.42069 0.9125
102 NXX 0.419118 0.910256
103 DND 0.419118 0.910256
104 AV2 0.418033 0.848101
105 COA 0.417808 0.788889
106 3UK 0.417323 0.897436
107 OOB 0.416 0.909091
108 IVC 0.415584 0.78022
109 DAT 0.415254 0.8375
110 NDO 0.414966 0.897436
111 139 0.414286 0.901235
112 3AT 0.413223 0.896104
113 TAT 0.413223 0.886076
114 YLB 0.413043 0.784091
115 62F 0.4125 0.823529
116 ABM 0.412281 0.848101
117 YAP 0.412214 0.875
118 YLP 0.411765 0.784091
119 ME8 0.410853 0.802326
120 NB8 0.410853 0.853659
121 SON 0.410256 0.886076
122 DLL 0.409449 0.909091
123 AHX 0.409449 0.853659
124 COS 0.409396 0.771739
125 AMX 0.409396 0.797753
126 CAO 0.409396 0.763441
127 30N 0.409396 0.72449
128 7D5 0.409091 0.8125
129 4UW 0.408759 0.9125
130 APX 0.407692 0.841463
131 SRA 0.40708 0.85
132 CMX 0.406667 0.788889
133 SCO 0.406667 0.788889
134 TYM 0.405797 0.886076
135 COD 0.405594 0.777778
136 OXK 0.405229 0.771739
137 CA6 0.405229 0.70297
138 A12 0.405172 0.886076
139 AP2 0.405172 0.886076
140 9SN 0.40458 0.853659
141 LAQ 0.404412 0.802326
142 T5A 0.404255 0.914634
143 FAM 0.403974 0.771739
144 ACO 0.403974 0.763441
145 FCX 0.403974 0.763441
146 AMP MG 0.403509 0.825
147 VO4 ADP 0.403226 0.860759
148 ADP VO4 0.403226 0.860759
149 YLC 0.402878 0.823529
150 1VU 0.402597 0.763441
151 FA5 0.401515 0.886076
152 HAX 0.401316 0.771739
153 APU 0.4 0.923077
154 TXA 0.4 0.886076
155 A U 0.4 0.898734
156 4UU 0.4 0.948052
157 AFH 0.4 0.843373
158 CAJ 0.4 0.771739
159 AR6 AR6 0.4 0.871795
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1DR1; Ligand: NAP; Similar sites found: 364
This union binding pocket(no: 1) in the query (biounit: 1dr1.bio2) has 38 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1UO4 PIH 0.0001553 0.56294 None
2 3QDY A2G GAL 0.0002226 0.53201 None
3 3QDT A2G GAL 0.0002833 0.52664 None
4 2BZ1 TAU 0.0013 0.52296 None
5 1UO5 PIH 0.001595 0.5178 None
6 3B6C SDN 0.005881 0.45669 None
7 3QDY CBS 0.005011 0.45563 None
8 1Y9Q MED 0.006084 0.44521 None
9 2IYG FMN 0.001507 0.44508 None
10 1NU4 MLA 0.02671 0.43837 None
11 1YRX FMN 0.001332 0.43786 None
12 2WCI GSH 0.006773 0.4373 None
13 2OFE NAG 0.01186 0.4313 None
14 1N9L FMN 0.001272 0.43014 None
15 3KYF 5GP 5GP 0.01695 0.42321 None
16 3SJ0 DXC 0.0271 0.41917 None
17 1LNX URI 0.0183 0.41261 None
18 3KMT SAH 0.007443 0.41258 None
19 2ZSC BTN 0.007829 0.4117 None
20 3NOJ PYR 0.04966 0.41062 None
21 1SJW NGV 0.02902 0.40096 None
22 3QV9 QV7 0.007381 0.43557 1.0582
23 1QDS PGA 0.004585 0.42974 1.0582
24 4ORR PE3 0.001351 0.40794 1.0582
25 3EWR APR 0.011 0.40052 1.19048
26 4K30 NLG 0.001016 0.46897 1.25
27 1JAY F42 0.03683 0.4056 1.41509
28 1V6A TRE 0.000262 0.5026 1.5873
29 4JP3 CIT 0.003574 0.42968 1.5873
30 1ZZ7 S0H 0.0109 0.42276 1.5873
31 2CZL TLA 0.02847 0.42017 1.5873
32 3IPQ 965 0.0008117 0.40277 1.5873
33 3F81 STT 0.003198 0.4808 1.63934
34 3ZPG 5GP 0.008647 0.4577 2.1164
35 4LHM AZZ 0.005098 0.44302 2.1164
36 1F3L SAH 0.0005648 0.43089 2.1164
37 3B5J 12D 0.02735 0.42027 2.1164
38 1UAY ADN 0.02123 0.4109 2.1164
39 1RYI GOA 0.000221 0.40622 2.1164
40 2PFY PCA 0.04325 0.40142 2.1164
41 2FKA BEF 0.007652 0.44498 2.32558
42 2BES RES 0.03968 0.40051 2.32558
43 2ZWS PLM 0.00279 0.50366 2.6455
44 1O9U ADZ 0.001962 0.49211 2.6455
45 2EB5 OXL 0.001149 0.47982 2.6455
46 3K3G MMU 0.0007321 0.4786 2.6455
47 1MZV AMP 0.0006019 0.46696 2.6455
48 3SHR CMP 0.001162 0.45491 2.6455
49 1BUC CAA 0.0001043 0.4476 2.6455
50 4RPM HXC 0.03878 0.43672 2.6455
51 1T10 F6P 0.02107 0.4272 2.6455
52 1SJD NPG 0.000508 0.42506 2.6455
53 1GOJ ADP 0.02975 0.4245 2.6455
54 3DNT ATP 0.0007489 0.42304 2.6455
55 1QPR PHT 0.02902 0.42182 2.6455
56 2A2X NA9 0.002316 0.42052 2.6455
57 3GX0 GDS 0.003029 0.4126 2.6455
58 2ZO9 MLI 0.01135 0.41103 2.6455
59 2ORV 4TA 0.001572 0.40896 2.6455
60 1TFZ 869 0.005396 0.40355 2.6455
61 2YVF FAD 0.001097 0.40105 2.6455
62 2BOI MFU 0.005854 0.43489 2.65487
63 1ULE GLA GAL NAG 0.003959 0.46789 2.66667
64 3QP4 HL0 0.002135 0.4299 2.74725
65 1ZS6 ADP 0.00079 0.46772 2.95858
66 3GM5 CIT 0.01436 0.42732 3.14465
67 4M5P MLA 0.006377 0.47319 3.1746
68 4KCT PYR 0.000621 0.47226 3.1746
69 4M5P 23W 0.004255 0.46629 3.1746
70 2Y6P CTP 0.0006303 0.46612 3.1746
71 3CQ5 PMP 0.001444 0.45635 3.1746
72 1DXY COI 0.009221 0.45621 3.1746
73 3O2K QRP 0.001543 0.44971 3.1746
74 1A59 COA 0.000771 0.43817 3.1746
75 4M37 SAH 0.0007061 0.43539 3.1746
76 3H9E NAD 0.0002192 0.42963 3.1746
77 2IYA UDP 0.006511 0.42887 3.1746
78 2Z1U ATP 0.002391 0.42799 3.1746
79 1TDF NAP 0.0002233 0.4273 3.1746
80 4KCT FDP 0.004169 0.42693 3.1746
81 3E6J DR2 0.03972 0.42524 3.1746
82 2AG8 NAP 0.001644 0.41849 3.1746
83 1O0S NAI 0.001425 0.41366 3.1746
84 2Q09 DI6 0.01473 0.41242 3.1746
85 3A2Y TS5 0.005142 0.41129 3.1746
86 3P7I P7I 0.01964 0.41123 3.1746
87 1A59 CIT 0.04007 0.41063 3.1746
88 2YAJ 4HP 0.02614 0.4098 3.1746
89 2P3V SRT 0.04937 0.40881 3.1746
90 4HSE ADP 0.02927 0.40729 3.1746
91 3O2K DST 0.02701 0.40496 3.1746
92 1MVN FMN 0.009173 0.40387 3.1746
93 4D7M TDC 0.001468 0.40373 3.1746
94 3SJ7 NDP 0.001061 0.40218 3.1746
95 1G7C 5GP 0.04563 0.4007 3.1746
96 2GTE VA 0.008169 0.40872 3.22581
97 1SS4 CIT 0.0004323 0.5432 3.26797
98 1SS4 GSH 0.006747 0.47808 3.26797
99 3RF4 FUN 0.003918 0.44271 3.44828
100 1Y2W NAG 0.009747 0.4354 3.52113
101 9LDT OXM 0.002527 0.49558 3.7037
102 3BHO B4P 0.008417 0.46647 3.7037
103 4B9E FAH 0.003465 0.46357 3.7037
104 3ZF8 GDP 0.001383 0.45171 3.7037
105 1JH7 UVC 0.005104 0.44299 3.7037
106 3MAG 3MA 0.02442 0.44057 3.7037
107 2VDJ HSE 0.01479 0.43843 3.7037
108 3JQ3 ADP 0.005115 0.42773 3.7037
109 4L6C 0BT 0.0008032 0.42564 3.7037
110 1Q11 TYE 0.009562 0.42531 3.7037
111 2ZYF AKG 0.008787 0.42222 3.7037
112 1NNS ASP 0.008215 0.41902 3.7037
113 2QV7 ADP 0.0131 0.41781 3.7037
114 2X1E X1E 0.02439 0.41543 3.7037
115 1QH8 HCA 0.04757 0.4124 3.7037
116 3DG6 MUC 0.009731 0.40791 3.7037
117 1R6D NAD 0.0004757 0.40618 3.7037
118 1FW1 GSH 0.01156 0.40491 3.7037
119 1R6D DAU 0.0005047 0.40459 3.7037
120 3PMD 11A 0.01191 0.41218 3.92157
121 1WRA PC 0.0008267 0.49435 4.2328
122 1H0C AOA 0.003131 0.46574 4.2328
123 3TFC PEP 0.002492 0.45152 4.2328
124 2AWN ADP 0.01624 0.44335 4.2328
125 3PLN U5P 0.004167 0.44151 4.2328
126 2YCD GTB 0.002528 0.43586 4.2328
127 2FOI JPA 0.003719 0.43358 4.2328
128 1Z44 FMN 0.003055 0.42804 4.2328
129 3PMA SCR 0.006346 0.42699 4.2328
130 4HA6 FAD 0.00003964 0.42583 4.2328
131 3NHB ADP 0.0275 0.42237 4.2328
132 1Z41 FMN 0.003472 0.42169 4.2328
133 1Z48 FMN 0.003922 0.41963 4.2328
134 1XVA SAM 0.001941 0.41957 4.2328
135 3P3N AKG 0.02117 0.4192 4.2328
136 1JJ7 ADP 0.04091 0.41868 4.2328
137 3VCA PRO 0.01567 0.41798 4.2328
138 3L0E G58 0.0005361 0.41745 4.2328
139 4LN7 1ZQ 0.003555 0.41737 4.2328
140 3U1T MLI 0.02042 0.41636 4.2328
141 3I0O ADP 0.009885 0.41562 4.2328
142 3Q3H UDP 0.03938 0.41155 4.2328
143 1R6N 434 0.042 0.40903 4.2328
144 2WA4 069 0.0125 0.4073 4.2328
145 1A27 EST 0.008254 0.40703 4.2328
146 3CV2 COA 0.0468 0.40697 4.2328
147 1UF5 CDT 0.0177 0.40487 4.2328
148 2I3G NAP 0.0005412 0.40218 4.2328
149 2D7I UDP 0.03692 0.40212 4.2328
150 4PNI KQQ 0.002757 0.40096 4.2328
151 1ZJ6 G3D 0.001093 0.4508 4.27807
152 1LSS NAD 0.0003538 0.44195 4.28571
153 1MXI SAH 0.0006735 0.44033 4.375
154 1C1L GAL BGC 0.0004394 0.50792 4.37956
155 2O66 FLC 0.003718 0.44936 4.44444
156 3DUR KDO 0.03632 0.40331 4.46429
157 4AKB GAL 0.02111 0.41157 4.51128
158 2JBH 5GP 0.0006718 0.47078 4.7619
159 1C7S CBS 0.0005432 0.46325 4.7619
160 1XIU REA 0.0005073 0.4494 4.7619
161 2IZ1 ATR 0.01255 0.43012 4.7619
162 4IMG NGF 0.001874 0.42012 4.7619
163 2NCD ADP 0.01715 0.41856 4.7619
164 2B7N NTM 0.0199 0.41555 4.7619
165 2C5S AMP 0.01283 0.41504 4.7619
166 3GQT UFO 0.02107 0.41458 4.7619
167 1TZJ A3B 0.04203 0.4105 4.7619
168 2QTR NXX 0.0004903 0.40625 4.7619
169 1EYE PMM 0.01441 0.40477 4.7619
170 2QF7 COA 0.01171 0.40469 4.7619
171 2GJN FMN 0.001783 0.40407 4.7619
172 3UEC ALA ARG TPO LYS 0.001216 0.48607 4.79452
173 4EXO PYR 0.007963 0.45229 4.79452
174 4N7C AEF 0.008821 0.44346 5.11364
175 2HT6 GDP 0.047 0.40354 5.17241
176 5RHN 8BR 0.006066 0.41225 5.21739
177 1FWV SGA MAG FUC 0.02207 0.42672 5.22388
178 1H8G CHT 0.0007031 0.5385 5.26316
179 2ZJ5 ADP 0.0005328 0.48836 5.29101
180 1QO0 BMD 0.004657 0.45076 5.29101
181 2GWD GLU 0.002211 0.4483 5.29101
182 2QCX PF1 0.00534 0.44208 5.29101
183 1H16 PYR 0.01544 0.43746 5.29101
184 2ZB3 NDP 0.00007505 0.43672 5.29101
185 3TKA CTN 0.03073 0.42471 5.29101
186 3TDC 0EU 0.001105 0.42399 5.29101
187 1EJH M7G 0.03106 0.42033 5.29101
188 1PEA ACM 0.03313 0.42027 5.29101
189 3W68 4PT 0.02491 0.41733 5.29101
190 4KOA NDP 0.003862 0.41601 5.29101
191 2VZ6 FEF 0.02133 0.41431 5.29101
192 1M5B BN1 0.0003193 0.41355 5.29101
193 1K6M AGS 0.002017 0.4119 5.29101
194 2FT0 ACO 0.02307 0.40583 5.29101
195 2VF7 ADP 0.03166 0.40555 5.29101
196 3TKA SAM 0.003857 0.40545 5.29101
197 3EB9 FLC 0.0318 0.40545 5.29101
198 2V6O FAD 0.001575 0.40414 5.29101
199 3I7S PYR 0.04639 0.40255 5.29101
200 2C31 ADP 0.001959 0.40014 5.29101
201 2FH5 GTP 0.0002395 0.45231 5.40541
202 3E5H GNP 0.0006404 0.42176 5.61798
203 3BY8 MLT 0.00181 0.47753 5.6338
204 1YOA FMN 0.02045 0.45312 5.66038
205 1YOA FAD 0.00226 0.41021 5.66038
206 3CH5 GDP 0.006272 0.41964 5.76923
207 4DN8 BMA 0.04286 0.40435 5.76923
208 2Q8H TF4 0.003185 0.48089 5.82011
209 4HA9 NDP 0.000001759 0.45411 5.82011
210 2RCN GDP 0.001986 0.44508 5.82011
211 4U9W COA 0.0009715 0.43872 5.82011
212 1KTC NGA 0.006488 0.43288 5.82011
213 1E5F PLP 0.004451 0.41748 5.82011
214 1PX8 XYP 0.0241 0.41166 5.82011
215 1SG4 CO8 0.0009169 0.41014 5.82011
216 3DER ALA LYS 0.003015 0.40922 5.82011
217 4OB6 S2T 0.007722 0.40816 5.82011
218 1V7R CIT 0.01749 0.44871 5.91398
219 1Y75 NAG 0.01269 0.41525 5.9322
220 1GU3 BGC BGC BGC BGC BGC 0.002048 0.45533 6.04027
221 2W3L DRO 0.007951 0.45965 6.25
222 1UW1 ADP 0.01756 0.41807 6.25
223 1Q6O LG6 0.0003548 0.46019 6.34921
224 2ACV UDP 0.004933 0.44234 6.34921
225 2Y7G AAE 0.001176 0.43997 6.34921
226 1XX4 BAM 0.005611 0.43835 6.34921
227 3NFZ 3NF 0.002535 0.43581 6.34921
228 3MD0 GDP 0.006389 0.42825 6.34921
229 3A1I UNU 0.008234 0.41898 6.34921
230 2IYF UDP 0.01269 0.41848 6.34921
231 1C3X 8IG 0.04303 0.4122 6.34921
232 2NLI FMN 0.0003846 0.41131 6.34921
233 1F5F DHT 0.007629 0.40478 6.34921
234 2NLI LAC 0.0009446 0.40209 6.34921
235 2HFK E4H 0.03393 0.40046 6.34921
236 1WDA BAG 0.02811 0.4001 6.34921
237 2F59 INI 0.002878 0.41703 6.36943
238 3ZEI AWH 0.0005567 0.41059 6.45161
239 4JHG ZEA 0.00125 0.43893 6.54762
240 1Y1A GSH 0.01837 0.45576 6.55738
241 1GXU 2HP 0.0225 0.44645 6.59341
242 2Q37 3AL 0.006983 0.43668 6.62983
243 1S8F GDP 0.001755 0.4013 6.77966
244 2Y7P SAL 0.001221 0.4654 6.87831
245 1GJW MAL 0.002042 0.44457 6.87831
246 1GJW GLC 0.009866 0.44104 6.87831
247 2VAR ANP 0.0005619 0.43488 6.87831
248 2VAR AMP 0.00396 0.43243 6.87831
249 2VAR KDF 0.003822 0.42848 6.87831
250 4WVH ASP HIS ASP ALA HIS ALA 0.008044 0.42389 6.87831
251 2VAR KDG 0.006596 0.41874 6.87831
252 4ASJ N6A 0.001545 0.41248 6.87831
253 1Y42 TYR 0.01848 0.41242 6.87831
254 4PLG OXM 0.0001371 0.40435 6.87831
255 4PLG NAI 0.0001371 0.40435 6.87831
256 1DBT U5P 0.006551 0.40382 6.87831
257 1B5E DCM 0.02808 0.40013 6.87831
258 1TH8 ADP 0.0006634 0.46518 6.89655
259 1Y7P RIP 0.003149 0.473 7.40741
260 4JWX 1N4 0.001794 0.45791 7.40741
261 1F1V DHY 0.004583 0.43454 7.40741
262 2Z9V PXM 0.006857 0.4318 7.40741
263 2OBM ADP 0.02721 0.42504 7.40741
264 1W7J ADP BEF 0.002558 0.42279 7.40741
265 4NAO AKG 0.03519 0.41347 7.40741
266 2J5B TYE 0.04808 0.41175 7.40741
267 4C6F DOR 0.01402 0.40918 7.40741
268 4C6F NCD 0.01402 0.40918 7.40741
269 3HGM ATP 0.01487 0.40285 7.48299
270 4F8L GAL 0.001519 0.51903 7.58621
271 2YIV NBN 0.002794 0.46819 7.93651
272 2YIV YIV 0.01019 0.44677 7.93651
273 3EYK EYK 0.03409 0.43841 7.93651
274 4OHB 5HM 0.002197 0.42942 7.93651
275 1G6H ADP 0.03019 0.42488 7.93651
276 4CCO OGA 0.01114 0.42233 7.93651
277 1Z4V DAN 0.006507 0.41899 7.93651
278 2OAT PFM 0.005027 0.41166 7.93651
279 2PP3 LGT 0.007872 0.4116 7.93651
280 3HAZ NAD 0.0006229 0.40615 7.93651
281 4Q0A 4OA 0.007237 0.40222 7.93651
282 3CF6 SP1 0.002047 0.43061 8.38323
283 1I0Z OXM 0.003846 0.47651 8.46561
284 4IHQ ADP 0.002043 0.44979 8.46561
285 1RZM PEP 0.003512 0.44484 8.46561
286 1YQT ADP 0.01289 0.44115 8.46561
287 3WCS MAN NAG 0.02364 0.42375 8.46561
288 1RZM E4P 0.02638 0.41975 8.46561
289 2YDW WSH 0.003263 0.43598 8.49673
290 2FR6 URI 0.001863 0.42401 8.90411
291 2FR6 CTN 0.004127 0.41125 8.90411
292 4COQ SAN 0.007704 0.4403 8.99471
293 1B7Y FYA 0.001279 0.4087 8.99471
294 2PR5 FMN 0.0007538 0.43853 9.09091
295 1OGD RIP 0.01332 0.41883 9.16031
296 2Q28 ADP 0.0002298 0.45295 9.52381
297 1G8S MET 0.007232 0.44161 9.52381
298 3FPZ AHZ 0.0002205 0.43158 9.52381
299 4E28 9MZ 0.01218 0.43075 9.52381
300 1VE3 SAM 0.00156 0.42686 9.52381
301 4E28 0MZ 0.0212 0.41427 9.52381
302 3BOS CDP 0.02673 0.4129 9.52381
303 2NUN ADP 0.03936 0.4077 9.52381
304 3AYS CT3 0.01625 0.40645 9.52381
305 2C04 GCP 0.02039 0.40529 9.52381
306 4JCA CIT 0.002177 0.49919 9.58084
307 3KJQ B94 0.001922 0.44074 9.7561
308 1UOU CMU 0.001819 0.43703 10.0529
309 1I2L DCS 0.001477 0.42384 10.0529
310 1BTN I3P 0.006995 0.47461 10.3774
311 1U5R ATP 0.00007039 0.48748 10.582
312 4C2G ALA ALA ALA ALA 0.0008961 0.46534 10.582
313 2CJZ PTR 0.01502 0.43785 10.582
314 1T0S BML 0.04695 0.40363 10.582
315 1XE7 GUN 0.002786 0.48399 11.1111
316 4JEJ 1GP 0.002953 0.43309 11.1111
317 2VKL MLT 0.03966 0.42867 11.1111
318 3PC3 P1T 0.001896 0.41631 11.1111
319 2WK1 SAH 0.002112 0.41466 11.1111
320 2BII MTV 0.002143 0.40771 11.1111
321 3BRE C2E 0.005956 0.44565 11.6402
322 1EB9 HBA 0.004309 0.42634 11.6402
323 2J0B UDP 0.005472 0.46441 12.1693
324 4G4S LDZ 0.0006899 0.44435 12.1693
325 2XDQ MGX 0.04002 0.42187 12.1693
326 2WMO GTP 0.005744 0.41708 12.1693
327 2FYU FDN 0.003101 0.41584 12.1693
328 3R51 MMA 0.001304 0.50158 12.5
329 2F2U M77 0.0002449 0.48343 12.6984
330 2JFV FLC 0.001918 0.46918 12.6984
331 2NVK NAP 0.004326 0.44078 12.6984
332 2Q1A 2KT 0.01215 0.4308 12.6984
333 1E4E PHY 0.004035 0.41914 12.6984
334 4RJK PYR 0.006076 0.45833 13.2275
335 4M51 BEZ 0.0105 0.4461 13.2275
336 1SQ5 ADP 0.001958 0.44041 13.2275
337 1SQ5 PAU 0.007038 0.43129 13.2275
338 3ANY 2A3 0.02238 0.42492 13.2275
339 2RGH FAD 0.00007196 0.40267 13.2275
340 1KBI PYR 0.001596 0.40259 13.2275
341 1KBI FMN 0.001596 0.40259 13.2275
342 2VPR TDC 0.001444 0.4365 13.7566
343 1SC3 MLI 0.00228 0.48019 14.0449
344 4PTZ FMN 0.004739 0.41263 14.2857
345 2DWU DGL 0.001134 0.4609 15.3439
346 1CKM GTP 0.006825 0.427 15.3439
347 2R5T ANP 0.002529 0.40853 15.3439
348 3B9Q MLI 0.03327 0.42534 15.873
349 3S9K CIT 0.00007223 0.60578 16.1017
350 2QLX RM4 0.002226 0.47308 16.6667
351 2V5E SCR 0.04801 0.42395 16.8317
352 1J78 OLA 0.005375 0.45622 16.9312
353 3HBF UDP 0.00511 0.42687 17.9894
354 4IXW IXW 0.01227 0.41588 19.5767
355 2E1A MSE 0.002458 0.4463 21.3333
356 1YBH P22 0.0302 0.41012 23.2804
357 1YBH FAD 0.0001435 0.40639 23.2804
358 3LTW HLZ 0.007204 0.44169 24.8677
359 1ECM TSA 0.00594 0.42963 25.6881
360 4F4S EFO 0.00343 0.4453 26.3158
361 1NHZ 486 0.0008261 0.42522 26.9841
362 2VOH CIT 0.02801 0.42571 30.7692
363 4EIL NDP 0.0000000000000685 0.84251 48.6772
364 4EIL FOL 0.00000002053 0.70772 48.6772
Pocket No.: 2; Query (leader) PDB : 1DR1; Ligand: HBI; Similar sites found: 304
This union binding pocket(no: 2) in the query (biounit: 1dr1.bio2) has 38 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1UO4 PIH 0.0001553 0.56294 None
2 3QDY A2G GAL 0.0002226 0.53201 None
3 3QDT A2G GAL 0.0002833 0.52664 None
4 2BZ1 TAU 0.0013 0.52296 None
5 1UO5 PIH 0.001595 0.5178 None
6 3QDY CBS 0.005011 0.45563 None
7 1Y9Q MED 0.006084 0.44521 None
8 2IYG FMN 0.001507 0.44508 None
9 1NU4 MLA 0.02671 0.43837 None
10 1YRX FMN 0.001332 0.43786 None
11 2WCI GSH 0.006773 0.4373 None
12 2OFE NAG 0.01186 0.4313 None
13 1N9L FMN 0.001272 0.43014 None
14 3SJ0 DXC 0.0271 0.41917 None
15 1LNX URI 0.0183 0.41261 None
16 3KMT SAH 0.007443 0.41258 None
17 2ZSC BTN 0.007829 0.4117 None
18 3NOJ PYR 0.03128 0.40417 None
19 3QV9 QV7 0.007381 0.43557 1.0582
20 1QDS PGA 0.004585 0.42974 1.0582
21 4ORR PE3 0.001351 0.40794 1.0582
22 4K30 NLG 0.001016 0.46897 1.25
23 1V6A TRE 0.000262 0.5026 1.5873
24 4JP3 CIT 0.003574 0.42968 1.5873
25 1ZZ7 S0H 0.0109 0.42276 1.5873
26 3IPQ 965 0.0008117 0.40277 1.5873
27 3F81 STT 0.003198 0.4808 1.63934
28 3ZPG 5GP 0.008647 0.4577 2.1164
29 4LHM AZZ 0.005098 0.44302 2.1164
30 1F3L SAH 0.0005648 0.43089 2.1164
31 2DT5 NAD 0.0002732 0.41666 2.1164
32 1RYI GOA 0.000221 0.40622 2.1164
33 2ZWS PLM 0.00279 0.50366 2.6455
34 1O9U ADZ 0.001962 0.49211 2.6455
35 2EB5 OXL 0.001149 0.47982 2.6455
36 3K3G MMU 0.0007321 0.4786 2.6455
37 1MZV AMP 0.0006019 0.46696 2.6455
38 3SHR CMP 0.001162 0.45491 2.6455
39 1BUC CAA 0.0001043 0.4476 2.6455
40 1T10 F6P 0.00523 0.4425 2.6455
41 4RPM HXC 0.03878 0.43672 2.6455
42 1SJD NPG 0.000508 0.42506 2.6455
43 3DNT ATP 0.0007489 0.42304 2.6455
44 2A2X NA9 0.002316 0.42052 2.6455
45 3GX0 GDS 0.003029 0.4126 2.6455
46 2ZO9 MLI 0.01135 0.41103 2.6455
47 2ORV 4TA 0.001572 0.40896 2.6455
48 1TFZ 869 0.005396 0.40355 2.6455
49 2YVF FAD 0.001097 0.40105 2.6455
50 2BOI MFU 0.005854 0.43489 2.65487
51 1ULE GLA GAL NAG 0.003959 0.46789 2.66667
52 3QP4 HL0 0.002135 0.4299 2.74725
53 1ZS6 ADP 0.00079 0.46772 2.95858
54 3GM5 CIT 0.01436 0.42732 3.14465
55 4M5P MLA 0.006377 0.47319 3.1746
56 4KCT PYR 0.000621 0.47226 3.1746
57 4M5P 23W 0.004255 0.46629 3.1746
58 2Y6P CTP 0.0006303 0.46612 3.1746
59 3CQ5 PMP 0.001444 0.45635 3.1746
60 1DXY COI 0.009221 0.45621 3.1746
61 3O2K QRP 0.001543 0.44971 3.1746
62 1A59 COA 0.000771 0.43817 3.1746
63 4M37 SAH 0.0007061 0.43539 3.1746
64 3H9E NAD 0.0002192 0.42963 3.1746
65 2Z1U ATP 0.002391 0.42799 3.1746
66 1TDF NAP 0.0002233 0.4273 3.1746
67 1MVN PCO 0.00009796 0.42729 3.1746
68 4KCT FDP 0.004169 0.42693 3.1746
69 3E6J DR2 0.03972 0.42524 3.1746
70 2AG8 NAP 0.001644 0.41849 3.1746
71 1MVN FMN 0.0000507 0.4167 3.1746
72 1O0S NAI 0.001425 0.41366 3.1746
73 2Q09 DI6 0.01473 0.41242 3.1746
74 3A2Y TS5 0.005142 0.41129 3.1746
75 3P7I P7I 0.01964 0.41123 3.1746
76 1A59 CIT 0.04007 0.41063 3.1746
77 1BDB NAD 0.00087 0.4103 3.1746
78 3O2K DST 0.02701 0.40496 3.1746
79 4D7M TDC 0.001468 0.40373 3.1746
80 3SJ7 NDP 0.001061 0.40218 3.1746
81 1SS4 CIT 0.0004323 0.5432 3.26797
82 1SS4 GSH 0.006747 0.47808 3.26797
83 3RF4 FUN 0.003918 0.44271 3.44828
84 1Y2W NAG 0.009747 0.4354 3.52113
85 9LDT OXM 0.002527 0.49558 3.7037
86 3BHO B4P 0.008417 0.46647 3.7037
87 4B9E FAH 0.003465 0.46357 3.7037
88 3ZF8 GDP 0.001383 0.45171 3.7037
89 1JH7 UVC 0.005104 0.44299 3.7037
90 3MAG 3MA 0.02442 0.44057 3.7037
91 2VDJ HSE 0.01479 0.43843 3.7037
92 3JQ3 ADP 0.005115 0.42773 3.7037
93 4L6C 0BT 0.0008032 0.42564 3.7037
94 1Q11 TYE 0.009562 0.42531 3.7037
95 2ZYF AKG 0.008787 0.42222 3.7037
96 1NNS ASP 0.008215 0.41902 3.7037
97 2QV7 ADP 0.005815 0.41296 3.7037
98 3DG6 MUC 0.009731 0.40791 3.7037
99 1R6D NAD 0.0004757 0.40618 3.7037
100 1FW1 GSH 0.01156 0.40491 3.7037
101 1R6D DAU 0.0005047 0.40459 3.7037
102 3PMD 11A 0.01191 0.41218 3.92157
103 1WRA PC 0.0008267 0.49435 4.2328
104 1H0C AOA 0.003131 0.46574 4.2328
105 3TFC PEP 0.002492 0.45152 4.2328
106 3U1T MLI 0.008439 0.44441 4.2328
107 3PLN U5P 0.004167 0.44151 4.2328
108 2YCD GTB 0.002528 0.43586 4.2328
109 2FOI JPA 0.003719 0.43358 4.2328
110 1Z44 FMN 0.003055 0.42804 4.2328
111 4HA6 FAD 0.00003964 0.42583 4.2328
112 1Z41 FMN 0.003472 0.42169 4.2328
113 1Z48 FMN 0.003922 0.41963 4.2328
114 1XVA SAM 0.001941 0.41957 4.2328
115 3P3N AKG 0.02117 0.4192 4.2328
116 3VCA PRO 0.01567 0.41798 4.2328
117 3L0E G58 0.0005361 0.41745 4.2328
118 4LN7 1ZQ 0.003555 0.41737 4.2328
119 3I0O ADP 0.009885 0.41562 4.2328
120 2WA4 069 0.0125 0.4073 4.2328
121 1A27 EST 0.008254 0.40703 4.2328
122 1UF5 CDT 0.0177 0.40487 4.2328
123 2I3G NAP 0.0005412 0.40218 4.2328
124 4PNI KQQ 0.002757 0.40096 4.2328
125 1ZJ6 G3D 0.001093 0.4508 4.27807
126 1LSS NAD 0.0003538 0.44195 4.28571
127 1MXI SAH 0.0006735 0.44033 4.375
128 1C1L GAL BGC 0.0004394 0.50792 4.37956
129 2O66 FLC 0.003718 0.44936 4.44444
130 3DUR KDO 0.03632 0.40331 4.46429
131 2JBH 5GP 0.0006718 0.47078 4.7619
132 1C7S CBS 0.0005432 0.46325 4.7619
133 1XIU REA 0.0005073 0.4494 4.7619
134 2IZ1 ATR 0.01255 0.43012 4.7619
135 4IMG NGF 0.001874 0.42012 4.7619
136 2NCD ADP 0.01715 0.41856 4.7619
137 2B7N NTM 0.0199 0.41555 4.7619
138 2C5S AMP 0.01283 0.41504 4.7619
139 2QTR NXX 0.0004903 0.40625 4.7619
140 1EYE PMM 0.01441 0.40477 4.7619
141 2QF7 COA 0.01171 0.40469 4.7619
142 2GJN FMN 0.001783 0.40407 4.7619
143 3UEC ALA ARG TPO LYS 0.001216 0.48607 4.79452
144 4EXO PYR 0.007963 0.45229 4.79452
145 4N7C AEF 0.008821 0.44346 5.11364
146 5RHN 8BR 0.006066 0.41225 5.21739
147 1H8G CHT 0.0007031 0.5385 5.26316
148 2ZJ5 ADP 0.0005328 0.48836 5.29101
149 1QO0 BMD 0.004657 0.45076 5.29101
150 2GWD GLU 0.002211 0.4483 5.29101
151 2QCX PF1 0.00534 0.44208 5.29101
152 1H16 PYR 0.01544 0.43746 5.29101
153 2ZB3 NDP 0.00007505 0.43672 5.29101
154 3TKA CTN 0.03073 0.42471 5.29101
155 1PEA ACM 0.03313 0.42027 5.29101
156 4KOA NDP 0.003862 0.41601 5.29101
157 1M5B BN1 0.0003193 0.41355 5.29101
158 1K6M AGS 0.002017 0.4119 5.29101
159 3TKA SAM 0.003857 0.40545 5.29101
160 2V6O FAD 0.001575 0.40414 5.29101
161 2C31 ADP 0.001959 0.40014 5.29101
162 2FH5 GTP 0.0002395 0.45231 5.40541
163 3E5H GNP 0.0006404 0.42176 5.61798
164 3BY8 MLT 0.00181 0.47753 5.6338
165 1YOA FMN 0.02045 0.45312 5.66038
166 1YOA FAD 0.00226 0.41021 5.66038
167 3CH5 GDP 0.006272 0.41964 5.76923
168 4DN8 BMA 0.04286 0.40435 5.76923
169 2Q8H TF4 0.003185 0.48089 5.82011
170 2RCN GDP 0.001986 0.44508 5.82011
171 4U9W COA 0.0009715 0.43872 5.82011
172 1QZZ SAM 0.001916 0.43614 5.82011
173 1KTC NGA 0.006488 0.43288 5.82011
174 1E5F PLP 0.004451 0.41748 5.82011
175 1PX8 XYP 0.0241 0.41166 5.82011
176 1SG4 CO8 0.0009169 0.41014 5.82011
177 3DER ALA LYS 0.003015 0.40922 5.82011
178 4OB6 S2T 0.007722 0.40816 5.82011
179 1V7R CIT 0.01749 0.44871 5.91398
180 1Y75 NAG 0.01269 0.41525 5.9322
181 1GU3 BGC BGC BGC BGC BGC 0.002048 0.45533 6.04027
182 2W3L DRO 0.007951 0.45965 6.25
183 1UW1 ADP 0.01756 0.41807 6.25
184 1Q6O LG6 0.0003548 0.46019 6.34921
185 2Y7G AAE 0.001176 0.43997 6.34921
186 1XX4 BAM 0.005611 0.43835 6.34921
187 3NFZ 3NF 0.002535 0.43581 6.34921
188 3MD0 GDP 0.006389 0.42825 6.34921
189 3A1I UNU 0.008234 0.41898 6.34921
190 2NLI FMN 0.0003846 0.41131 6.34921
191 2HNK SAH 0.003452 0.41055 6.34921
192 1F5F DHT 0.007629 0.40478 6.34921
193 2NLI LAC 0.0009446 0.40209 6.34921
194 2HFK E4H 0.03393 0.40046 6.34921
195 1WDA BAG 0.02811 0.4001 6.34921
196 2F59 INI 0.002878 0.41703 6.36943
197 3ZEI AWH 0.0005567 0.41059 6.45161
198 4JHG ZEA 0.00125 0.43893 6.54762
199 1Y1A GSH 0.01837 0.45576 6.55738
200 2Q37 3AL 0.006983 0.43668 6.62983
201 1S8F GDP 0.001755 0.4013 6.77966
202 2Y7P SAL 0.001221 0.4654 6.87831
203 1GJW MAL 0.002042 0.44457 6.87831
204 1GJW GLC 0.009866 0.44104 6.87831
205 4JK3 NAD 0.00006847 0.43791 6.87831
206 2VAR ANP 0.0005619 0.43488 6.87831
207 2VAR AMP 0.00396 0.43243 6.87831
208 2VAR KDF 0.003822 0.42848 6.87831
209 4WVH ASP HIS ASP ALA HIS ALA 0.008044 0.42389 6.87831
210 2VAR KDG 0.006596 0.41874 6.87831
211 4ASJ N6A 0.001545 0.41248 6.87831
212 1Y42 TYR 0.01848 0.41242 6.87831
213 4PLG OXM 0.0001371 0.40435 6.87831
214 4PLG NAI 0.0001371 0.40435 6.87831
215 1DBT U5P 0.006551 0.40382 6.87831
216 1B5E DCM 0.02808 0.40013 6.87831
217 1TH8 ADP 0.0006634 0.46518 6.89655
218 1Y7P RIP 0.003149 0.473 7.40741
219 4JWX 1N4 0.001794 0.45791 7.40741
220 1F1V DHY 0.004583 0.43454 7.40741
221 2Z9V PXM 0.006857 0.4318 7.40741
222 1W7J ADP BEF 0.002558 0.42279 7.40741
223 4NAO AKG 0.03519 0.41347 7.40741
224 4C6F DOR 0.01402 0.40918 7.40741
225 4C6F NCD 0.01402 0.40918 7.40741
226 4F8L GAL 0.001519 0.51903 7.58621
227 2YIV NBN 0.002794 0.46819 7.93651
228 2YIV YIV 0.01019 0.44677 7.93651
229 4OHB 5HM 0.002197 0.42942 7.93651
230 4CCO OGA 0.01114 0.42233 7.93651
231 1Z4V DAN 0.006507 0.41899 7.93651
232 2OAT PFM 0.005027 0.41166 7.93651
233 2PP3 LGT 0.007872 0.4116 7.93651
234 1KYZ SAH 0.004352 0.41039 7.93651
235 3HAZ NAD 0.0006229 0.40615 7.93651
236 4Q0A 4OA 0.007237 0.40222 7.93651
237 3CF6 SP1 0.002047 0.43061 8.38323
238 1I0Z OXM 0.003846 0.47651 8.46561
239 4IHQ ADP 0.002043 0.44979 8.46561
240 1RZM PEP 0.003512 0.44484 8.46561
241 1RZM E4P 0.02638 0.41975 8.46561
242 2YDW WSH 0.003263 0.43598 8.49673
243 2FR6 URI 0.001863 0.42401 8.90411
244 2FR6 CTN 0.004127 0.41125 8.90411
245 4COQ SAN 0.007704 0.4403 8.99471
246 1B7Y FYA 0.001279 0.4087 8.99471
247 2PR5 FMN 0.0007538 0.43853 9.09091
248 1OGD RIP 0.01332 0.41883 9.16031
249 2Q28 ADP 0.0002298 0.45295 9.52381
250 1G8S MET 0.007232 0.44161 9.52381
251 3FPZ AHZ 0.0002205 0.43158 9.52381
252 4E28 9MZ 0.01218 0.43075 9.52381
253 1VE3 SAM 0.00156 0.42686 9.52381
254 4E28 0MZ 0.0212 0.41427 9.52381
255 3AYS CT3 0.01625 0.40645 9.52381
256 4JCA CIT 0.002177 0.49919 9.58084
257 3KJQ B94 0.001922 0.44074 9.7561
258 1UOU CMU 0.001819 0.43703 10.0529
259 1I2L DCS 0.001477 0.42384 10.0529
260 1BTN I3P 0.006995 0.47461 10.3774
261 1U5R ATP 0.00007039 0.48748 10.582
262 1T0S BML 0.001942 0.48377 10.582
263 4C2G ALA ALA ALA ALA 0.0008961 0.46534 10.582
264 1XE7 GUN 0.002786 0.48399 11.1111
265 4JEJ 1GP 0.002953 0.43309 11.1111
266 2VKL MLT 0.03966 0.42867 11.1111
267 3PC3 P1T 0.001896 0.41631 11.1111
268 2WK1 SAH 0.002112 0.41466 11.1111
269 2BII MTV 0.002143 0.40771 11.1111
270 3BRE C2E 0.005956 0.44565 11.6402
271 1EB9 HBA 0.004309 0.42634 11.6402
272 4G4S LDZ 0.0006899 0.44435 12.1693
273 2XDQ MGX 0.04002 0.42187 12.1693
274 2WMO GTP 0.005744 0.41708 12.1693
275 2FYU FDN 0.003101 0.41584 12.1693
276 3R51 MMA 0.001304 0.50158 12.5
277 2F2U M77 0.0002449 0.48343 12.6984
278 2JFV FLC 0.001918 0.46918 12.6984
279 2NVK NAP 0.004326 0.44078 12.6984
280 2Q1A 2KT 0.01215 0.4308 12.6984
281 1E4E PHY 0.004035 0.41914 12.6984
282 4RJK PYR 0.006076 0.45833 13.2275
283 4M51 BEZ 0.0105 0.4461 13.2275
284 1SQ5 ADP 0.001958 0.44041 13.2275
285 1SQ5 PAU 0.007038 0.43129 13.2275
286 2RGH FAD 0.00007196 0.40267 13.2275
287 1KBI PYR 0.001596 0.40259 13.2275
288 1KBI FMN 0.001596 0.40259 13.2275
289 2VPR TDC 0.001444 0.4365 13.7566
290 1SC3 MLI 0.00228 0.48019 14.0449
291 4PTZ FMN 0.004739 0.41263 14.2857
292 2DWU DGL 0.001134 0.4609 15.3439
293 1CKM GTP 0.006825 0.427 15.3439
294 2R5T ANP 0.002529 0.40853 15.3439
295 3S9K CIT 0.00007223 0.60578 16.1017
296 2QLX RM4 0.002226 0.47308 16.6667
297 2V5E SCR 0.04801 0.42395 16.8317
298 4IXW IXW 0.01227 0.41588 19.5767
299 2E1A MSE 0.002458 0.4463 21.3333
300 1YBH FAD 0.0001435 0.40639 23.2804
301 3LTW