# | PDB (Resolution Å) |
Site # | Ligand | EC number | GO terms | UniProt | PubMed | Binding affinity |
---|---|---|---|---|---|---|---|---|
1 | 1hw5:A (1.82) | BS01 | CMP | ? | GO:0003677 ... | P0ACJ8 | 11124966 | Manual survey: Kb=2.0+-0.3M^-1 (11124966) |
2 | 1hw5:A (1.82) | BS02 | CMP | ? | GO:0003677 ... | P0ACJ8 | 11124966 | Manual survey: Kb=2.0+-0.3M^-1 (11124966) |
3 | 1hw5:B (1.82) | BS01 | CMP | ? | GO:0003677 ... | P0ACJ8 | 11124966 | Manual survey: Kb=2.0+-0.3M^-1 (11124966) |
4 | 1hw5:B (1.82) | BS02 | CMP | ? | GO:0003677 ... | P0ACJ8 | 11124966 | Manual survey: Kb=2.0+-0.3M^-1 (11124966) |
5 | 1o9f:A (2.7) | BS01 | peptide | ? | GO:0005737 ... | P93343 | 12606564 | Manual survey: Kd=0.7uM (12606564) |
6 | 1o9f:A (2.7) | BS02 | FSC | ? | GO:0005737 ... | P93343 | 12606564 | Manual survey: Kd=0.7uM (12606564) |
7 | 1w25:A (2.7) | BS01 | MG | 2.7.7.65 | GO:0000160 ... | B8GZM2 | 15569936 | Manual survey: Ki=0.5uM (15569936) |
8 | 1w25:A (2.7) | BS02 | C2E | 2.7.7.65 | GO:0000160 ... | B8GZM2 | 15569936 | Manual survey: Ki=0.5uM (15569936) PDBbind: -logKd/Ki=6.30, Ki=0.5uM |
9 | 1w25:A (2.7) | BS03 | C2E | 2.7.7.65 | GO:0000160 ... | B8GZM2 | 15569936 | Manual survey: Ki=0.5uM (15569936) PDBbind: -logKd/Ki=6.30, Ki=0.5uM |
10 | 1w25:A (2.7) | BS04 | C2E | 2.7.7.65 | GO:0000160 ... | B8GZM2 | 15569936 | Manual survey: Ki=0.5uM (15569936) PDBbind: -logKd/Ki=6.30, Ki=0.5uM |
11 | 1w25:B (2.7) | BS01 | MG | 2.7.7.65 | GO:0000160 ... | B8GZM2 | 15569936 | Manual survey: Ki=0.5uM (15569936) |
12 | 1w25:B (2.7) | BS02 | C2E | 2.7.7.65 | GO:0000160 ... | B8GZM2 | 15569936 | Manual survey: Ki=0.5uM (15569936) |
13 | 1w25:B (2.7) | BS03 | C2E | 2.7.7.65 | GO:0000160 ... | B8GZM2 | 15569936 | Manual survey: Ki=0.5uM (15569936) |
14 | 1xui:A (1.5) | BS01 | CA | 3.4.21.4 | GO:0004175 ... | P00760 | 9468142 | Manual survey: Ki=19uM (9468142) |
15 | 1xui:A (1.5) | BS02 | BAO | 3.4.21.4 | GO:0004175 ... | P00760 | 9468142 | Manual survey: Ki=19uM (9468142) |
16 | 2o99:A (1.7) | BS01 | GOA | ? | N/A | P16528 | 17426033 | Manual survey: Kd=0.9+-2uM (17426033) |
17 | 2o99:B (1.7) | BS01 | GOA | ? | N/A | P16528 | 17426033 | Manual survey: Kd=0.9+-2uM (17426033) |
18 | 2o99:C (1.7) | BS01 | GOA | ? | N/A | P16528 | 17426033 | Manual survey: Kd=0.9+-2uM (17426033) |
19 | 2o99:D (1.7) | BS01 | GOA | ? | N/A | P16528 | 17426033 | Manual survey: Kd=0.9+-2uM (17426033) |
20 | 2our:A (1.45) | BS01 | CMP | 3.1.4.17 | GO:0004114 ... | Q9Y233 | 17389385 | Manual survey: Km=56nM (17389385) |
21 | 2ouy:A (1.9) | BS01 | ZN | 3.1.4.17 | GO:0004114 ... | Q9Y233 | 17389385 | Manual survey: Km=56nM (17389385) |
22 | 2ouy:A (1.9) | BS02 | CMP | 3.1.4.17 | GO:0004114 ... | Q9Y233 | 17389385 | Manual survey: Km=56nM (17389385) |
23 | 2oz6:A (2.8) | BS01 | CMP | ? | GO:0000976 ... | P55222 | 21665969 | Manual survey: Kd=1.0uM (21665969) PDBbind: -logKd/Ki=5.26, Kd=5.5uM |
24 | 2oz6:A (2.8) | BS02 | CMP | ? | GO:0000976 ... | P55222 | 21665969 | Manual survey: Kd=1.0uM (21665969) PDBbind: -logKd/Ki=5.26, Kd=5.5uM |
25 | 2ptm:A (1.93) | BS01 | CMP | ? | N/A | O76977 | 17562314 | Manual survey: K1/2=1.1uM (17562314) |
26 | 2pw3:A (1.56) | BS01 | ZN | 3.1.4.53 | GO:0004114 ... | Q08499 | 17582435 | Manual survey: Km=56nM (17562314) |
27 | 2pw3:A (1.56) | BS02 | CMP | 3.1.4.53 | GO:0004114 ... | Q08499 | 17582435 | Manual survey: Km=56nM (17562314) |
28 | 2pw3:B (1.56) | BS01 | ZN | 3.1.4.53 | GO:0004114 ... | Q08499 | 17582435 | Manual survey: Km=56nM (17562314) |
29 | 2pw3:B (1.56) | BS02 | CMP | 3.1.4.53 | GO:0004114 ... | Q08499 | 17582435 | Manual survey: Km=56nM (17562314) |
30 | 3auj:A (2.1) | BS01 | GOL | 4.2.1.28 | GO:0003824 ... | Q59470 | 22221669 | Manual survey: Km=1.2+-0.2mM (22221669) |
31 | 3auj:A (2.1) | BS02 | CA | 4.2.1.28 | GO:0003824 ... | Q59470 | 22221669 | Manual survey: Km=1.2+-0.2mM (22221669) |
32 | 3auj:A (2.1) | BS03 | B12 | 4.2.1.28 | GO:0003824 ... | Q59470 | 22221669 | Manual survey: Km=1.2+-0.2mM (22221669) |
33 | 3auj:L (2.1) | BS01 | GOL | 4.2.1.28 | GO:0003824 ... | Q59470 | 22221669 | Manual survey: Km=1.2+-0.2mM (22221669) |
34 | 3auj:L (2.1) | BS02 | CA | 4.2.1.28 | GO:0003824 ... | Q59470 | 22221669 | Manual survey: Km=1.2+-0.2mM (22221669) |
35 | 3auj:L (2.1) | BS03 | B12 | 4.2.1.28 | GO:0003824 ... | Q59470 | 22221669 | Manual survey: Km=1.2+-0.2mM (22221669) |
36 | 3etq:A (1.9) | BS01 | CMP | ? | N/A | O88703 | 19525958 | Manual survey: Kd=920+-240nM (19525958) |
37 | 3etq:B (1.9) | BS01 | CMP | ? | N/A | O88703 | 19525958 | Manual survey: Kd=920+-240nM (19525958) |
38 | 3klo:A (2.802) | BS01 | C2E | ? | GO:0000166 ... | Q9KKZ8 | 20150502 | Manual survey: Kd=3.18uM (20150502) |
39 | 3klo:B (2.802) | BS01 | C2E | ? | GO:0000166 ... | Q9KKZ8 | 20150502 | Manual survey: Kd=3.18uM (20150502) |
40 | 3klo:C (2.802) | BS01 | C2E | ? | GO:0000166 ... | Q9KKZ8 | 20150502 | Manual survey: Kd=3.18uM (20150502) |
41 | 3klo:D (2.802) | BS01 | C2E | ? | GO:0000166 ... | Q9KKZ8 | 20150502 | Manual survey: Kd=3.18uM (20150502) |
42 | 3ocp:A (2.49) | BS01 | CMP | 2.7.11.12 | N/A | Q13976 | 21526164 | Manual survey: Kd=27+-3.6nM (21526164) MOAD: Kd=27nM PDBbind: -logKd/Ki=7.57, Kd=27nM |
43 | 3ocp:B (2.49) | BS01 | CMP | 2.7.11.12 | N/A | Q13976 | 21526164 | Manual survey: Kd=27+-3.6nM (21526164) MOAD: Kd=27nM |
44 | 3od0:A (2.9) | BS01 | PCG | 2.7.11.12 | N/A | Q13976 | 21526164 | Manual survey: Kd=12+-1.6nM (21526164) PDBbind: -logKd/Ki=7.92, Kd=12nM |
45 | 3od0:A (2.9) | BS02 | PCG | 2.7.11.12 | N/A | Q13976 | 21526164 | Manual survey: Kd=12+-1.6nM (21526164) PDBbind: -logKd/Ki=7.92, Kd=12nM |
46 | 3od0:B (2.9) | BS01 | PCG | 2.7.11.12 | N/A | Q13976 | 21526164 | Manual survey: Kd=12+-1.6nM (21526164) PDBbind: -logKd/Ki=7.92, Kd=12nM |
47 | 3ogj:A (2.751) | BS01 | CMP | 2.7.11.12 | N/A | Q13976 | 21526164 | Manual survey: Kd=27+-3.6nM (21526164) |
48 | 3ogj:B (2.751) | BS01 | CMP | 2.7.11.12 | N/A | Q13976 | 21526164 | Manual survey: Kd=27+-3.6nM (21526164) |
49 | 3pjt:A (2.5154) | BS01 | C2E | ? | N/A | Q3KK31 | 21304926 | Manual survey: Kd=13.1uM (21304926) PDBbind: -logKd/Ki=4.88, Kd=13.1uM |
50 | 3pjt:B (2.5154) | BS01 | C2E | ? | N/A | Q3KK31 | 21304926 | Manual survey: Kd=13.1uM (21304926) |
51 | 3q6k:A (2.52) | BS01 | SRO | ? | GO:0005576 ... | Q5WPU9 | 21795673 | Manual survey: Kd=4.3nM (21795673) PDBbind: -logKd/Ki=8.37, Kd=4.3nM |
52 | 3q6k:B (2.52) | BS01 | SRO | ? | GO:0005576 ... | Q5WPU9 | 21795673 | Manual survey: Kd=4.3nM (21795673) |
53 | 3qyy:A (1.9) | BS01 | C2E | 2.7.7.65 | N/A | Q8P559 | 22120736 | Manual survey: Ki=6.54uM (22120736) MOAD: Kd=8.26uM PDBbind: -logKd/Ki=5.08, Kd=8.26uM |
54 | 3qyy:A (1.9) | BS02 | MG | 2.7.7.65 | N/A | Q8P559 | 22120736 | Manual survey: Ki=6.54uM (22120736) |
55 | 3qyy:A (1.9) | BS03 | C2E | 2.7.7.65 | N/A | Q8P559 | 22120736 | Manual survey: Ki=6.54uM (22120736) MOAD: Kd=8.26uM PDBbind: -logKd/Ki=5.08, Kd=8.26uM |
56 | 3qyy:B (1.9) | BS01 | C2E | 2.7.7.65 | N/A | Q8P559 | 22120736 | Manual survey: Ki=6.54uM (22120736) MOAD: Kd=8.26uM PDBbind: -logKd/Ki=5.08, Kd=8.26uM |
57 | 3qyy:B (1.9) | BS02 | C2E | 2.7.7.65 | N/A | Q8P559 | 22120736 | Manual survey: Ki=6.54uM (22120736) MOAD: Kd=8.26uM PDBbind: -logKd/Ki=5.08, Kd=8.26uM |
58 | 3qyy:B (1.9) | BS03 | MG | 2.7.7.65 | N/A | Q8P559 | 22120736 | Manual survey: Ki=6.54uM (22120736) |
59 | 3u0z:A (2.9) | BS01 | CMP | ? | N/A | O88704 | 22006928 | Manual survey: Kd=39.7nM (22006928) |
60 | 3u0z:B (2.9) | BS01 | CMP | ? | N/A | O88704 | 22006928 | Manual survey: Kd=39.7nM (22006928) |
61 | 3u10:A (2.3) | BS01 | CMP | ? | N/A | Q9UL51 | 22006928 | Manual survey: Kd=82.0nM (22006928) PDBbind: -logKd/Ki=5.44, Kd=3.6uM |
62 | 3u11:A (2.5) | BS01 | CMP | ? | N/A | Q9Y3Q4 | 22006928 | Manual survey: Kd=39.2nM (22006928) |
63 | 3u11:B (2.5) | BS01 | CMP | ? | N/A | Q9Y3Q4 | 22006928 | Manual survey: Kd=39.2nM (22006928) |
64 | 4dn0:A (2.3) | BS01 | C2E | ? | N/A | A0A0H2ZD98 | 22605337 | Manual survey: Kd=1.9uM (22605337) MOAD: Kd=1.9uM PDBbind: -logKd/Ki=5.72, Kd=1.9uM |
65 | 4dn0:A (2.3) | BS02 | C2E | ? | N/A | A0A0H2ZD98 | 22605337 | Manual survey: Kd=1.9uM (22605337) MOAD: Kd=1.9uM PDBbind: -logKd/Ki=5.72, Kd=1.9uM |
66 | 4ef4:A (2.147) | BS01 | C2E | ? | GO:0002218 ... | Q86WV6 | 22579474 | Manual survey: Kd=4.42uM (22579474) MOAD: Kd=4.42uM PDBbind: -logKd/Ki=5.35, Kd=4.42uM BindingDB: EC50=4500nM, Kd=1210nM |
67 | 4ef4:A (2.147) | BS02 | CA | ? | GO:0002218 ... | Q86WV6 | 22579474 | Manual survey: Kd=4.42uM (22579474) |
68 | 4ef4:B (2.147) | BS01 | C2E | ? | GO:0002218 ... | Q86WV6 | 22579474 | Manual survey: Kd=4.42uM (22579474) PDBbind: -logKd/Ki=5.35, Kd=4.42uM BindingDB: EC50=4500nM, Kd=1210nM |
69 | 4emt:A (1.5) | BS01 | C2E | ? | GO:0002218 ... | Q86WV6 | 22728658 | Manual survey: Kd=5uM (22728658) MOAD: Kd=4.63uM PDBbind: -logKd/Ki=5.30, Kd~5uM BindingDB: EC50=4500nM, Kd=1210nM |
70 | 4emt:B (1.5) | BS01 | C2E | ? | GO:0002218 ... | Q86WV6 | 22728658 | Manual survey: Kd=5uM (22728658) PDBbind: -logKd/Ki=5.30, Kd~5uM BindingDB: EC50=4500nM, Kd=1210nM |
71 | 4emt:B (1.5) | BS02 | CA | ? | GO:0002218 ... | Q86WV6 | 22728658 | Manual survey: Kd=5uM (22728658) |
72 | 4etz:A (2.05) | BS01 | C2E | ? | N/A | Q9HZE7 | 22810222 | Manual survey: Kd=0.5uM (22810222) MOAD: Kd~0.5uM PDBbind: -logKd/Ki=6.30, Kd=0.5uM |
73 | 4etz:B (2.05) | BS01 | C2E | ? | N/A | Q9HZE7 | 22810222 | Manual survey: Kd=0.5uM (22810222) MOAD: Kd~0.5uM |
74 | 4eu0:A (1.7) | BS01 | C2E | ? | N/A | Q9HZE7 | 22810222 | Manual survey: Kd=0.5uM (22810222) MOAD: Kd=0.4uM PDBbind: -logKd/Ki=6.40, Kd=0.4uM |
75 | 4euv:A (2.0) | BS01 | C2E | ? | N/A | Q9HZE7 | 22810222 | Manual survey: Kd=0.5uM (22810222) MOAD: Kd~0.5uM PDBbind: -logKd/Ki=6.30, Kd=0.5uM |
76 | 4f5y:A (2.396) | BS01 | CA | ? | GO:0002218 ... | Q86WV6 | 22728660 | Manual survey: Kd=3.7uM (22728660) |
77 | 4f5y:A (2.396) | BS02 | C2E | ? | GO:0002218 ... | Q86WV6 | 22728660 | Manual survey: Kd=3.7uM (22728660) PDBbind: -logKd/Ki=5.43, Kd=3.70uM BindingDB: EC50=4500nM, Kd=1210nM |
78 | 4f5y:B (2.396) | BS01 | C2E | ? | GO:0002218 ... | Q86WV6 | 22728660 | Manual survey: Kd=3.7uM (22728660) PDBbind: -logKd/Ki=5.43, Kd=3.70uM BindingDB: EC50=4500nM, Kd=1210nM |
79 | 4f5y:B (2.396) | BS02 | CA | ? | GO:0002218 ... | Q86WV6 | 22728660 | Manual survey: Kd=3.7uM (22728660) |
80 | 4f9g:A (2.95) | BS01 | C2E | ? | GO:0002218 ... | Q86WV6 | 22705373 | Manual survey: Km=2.4+-0.5mM (22705373) PDBbind: -logKd/Ki=5.62, Kd=2.4uM BindingDB: EC50=4500nM, Kd=1210nM |
81 | 4f9g:C (2.95) | BS01 | C2E | ? | GO:0002218 ... | Q86WV6 | 22705373 | Manual survey: Km=2.4+-0.5mM (22705373) PDBbind: -logKd/Ki=5.62, Kd=2.4uM BindingDB: EC50=4500nM, Kd=1210nM |