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- Structure Biounit | Ligand Information
- PDB : .ZIP | .CSV
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- Class : .ZIP | .CSV
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 8 families. | |||||
1 | 1KI6 | - | AHU | C10 H13 I N2 O5 | C1[C@@H](C.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 4 families. | |||||
1 | 1KI6 | - | AHU | C10 H13 I N2 O5 | C1[C@@H](C.... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | TMC | 0.9743 |
2 | 5BT | 0.9731 |
3 | THM | 0.9703 |
4 | 0DN | 0.9700 |
5 | MCY | 0.9513 |
6 | SCT | 0.9502 |
7 | B86 | 0.9473 |
8 | THU | 0.9351 |
9 | 3D1 | 0.9337 |
10 | 3DT | 0.9329 |
11 | BVD | 0.9328 |
12 | DCZ | 0.9304 |
13 | 5UD | 0.9276 |
14 | F01 | 0.9255 |
15 | DUR | 0.9254 |
16 | CL9 | 0.9244 |
17 | LLT | 0.9242 |
18 | ADN | 0.9235 |
19 | CTN | 0.9234 |
20 | 5AD | 0.9189 |
21 | FMC | 0.9188 |
22 | ETV | 0.9184 |
23 | 7D7 | 0.9182 |
24 | GNG | 0.9175 |
25 | A | 0.9172 |
26 | 5FD | 0.9165 |
27 | 5N5 | 0.9150 |
28 | RFZ | 0.9142 |
29 | URI | 0.9124 |
30 | AR3 | 0.9124 |
31 | 5AE | 0.9123 |
32 | NOS | 0.9114 |
33 | 1DA | 0.9113 |
34 | TBN | 0.9113 |
35 | GMP | 0.9085 |
36 | NWW | 0.9082 |
37 | GEO | 0.9076 |
38 | URD | 0.9062 |
39 | CTD | 0.9061 |
40 | LDC | 0.9058 |
41 | DDU | 0.9054 |
42 | A4D | 0.9039 |
43 | 3BH | 0.9038 |
44 | DCF | 0.9028 |
45 | 6MD | 0.9022 |
46 | HPR | 0.9021 |
47 | PRH | 0.9021 |
48 | 2TU | 0.9017 |
49 | PUR | 0.9015 |
50 | LTT | 0.9007 |
51 | TYU | 0.9003 |
52 | AZZ | 0.8989 |
53 | 3TC | 0.8988 |
54 | UUA | 0.8988 |
55 | 3L1 | 0.8972 |
56 | 5NB | 0.8969 |
57 | 5CD | 0.8954 |
58 | MTA | 0.8945 |
59 | I5A | 0.8943 |
60 | 5ID | 0.8939 |
61 | ZEB | 0.8922 |
62 | DHZ | 0.8917 |
63 | EKH | 0.8878 |
64 | 8HG | 0.8878 |
65 | 3AD | 0.8866 |
66 | CC5 | 0.8864 |
67 | TIZ | 0.8861 |
68 | 9UL | 0.8857 |
69 | KYN | 0.8855 |
70 | MG7 | 0.8851 |
71 | MIL | 0.8833 |
72 | PQT | 0.8829 |
73 | D1Y | 0.8821 |
74 | ENG | 0.8816 |
75 | XYA | 0.8803 |
76 | CDY | 0.8801 |
77 | CFE | 0.8792 |
78 | FTU | 0.8789 |
79 | TMP | 0.8779 |
80 | 5I5 | 0.8772 |
81 | K80 | 0.8747 |
82 | 89J | 0.8733 |
83 | BRD | 0.8725 |
84 | LVY | 0.8725 |
85 | MCF | 0.8724 |
86 | BWD | 0.8698 |
87 | QME | 0.8694 |
88 | NEU | 0.8694 |
89 | S0G | 0.8692 |
90 | W29 | 0.8687 |
91 | 8DA | 0.8686 |
92 | 78U | 0.8675 |
93 | S0E | 0.8674 |
94 | 1KN | 0.8654 |
95 | AUV | 0.8651 |
96 | AMR | 0.8651 |
97 | 7CI | 0.8644 |
98 | AOJ | 0.8635 |
99 | QMS | 0.8631 |
100 | KP2 | 0.8629 |
101 | XTS | 0.8623 |
102 | XYP AHR | 0.8618 |
103 | H7S | 0.8611 |
104 | 4R1 | 0.8610 |
105 | 657 | 0.8608 |
106 | 7AP | 0.8601 |
107 | E0O | 0.8598 |
108 | IOS | 0.8596 |
109 | 9FH | 0.8589 |
110 | SGP | 0.8578 |
111 | BG6 | 0.8572 |
112 | 22L | 0.8570 |
113 | 2O6 | 0.8550 |
114 | DTR | 0.8543 |
115 | LJ4 | 0.8530 |
116 | MAJ | 0.8529 |
117 | 51Y | 0.8526 |
This union binding pocket(no: 1) in the query (biounit: 1ki6.bio1) has 15 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 1ki6.bio1) has 15 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |