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- Structure Biounit | Ligand Information
- PDB : .ZIP | .CSV
- Family 90% : .ZIP | .CSV
- Class : .ZIP | .CSV
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 4 families. | |||||
1 | 5M7S | Ki = 0.9 nM | NHT | C9 H16 N2 O4 S | CCNC1=N[C@.... |
2 | 5M7U | Ki = 8 nM | XHA | C18 H25 F3 N2 O4 | CNC(=O)C[C.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 4 families. | |||||
1 | 5M7S | Ki = 0.9 nM | NHT | C9 H16 N2 O4 S | CCNC1=N[C@.... |
2 | 5M7U | Ki = 8 nM | XHA | C18 H25 F3 N2 O4 | CNC(=O)C[C.... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | GC3 | 0.9576 |
2 | NGO | 0.9340 |
3 | NGW | 0.9321 |
4 | TNX | 0.9234 |
5 | FER | 0.9226 |
6 | 5FN | 0.9174 |
7 | NOK | 0.9170 |
8 | YX1 | 0.9096 |
9 | TL5 | 0.9092 |
10 | NAG | 0.9072 |
11 | NSG | 0.9039 |
12 | TLM | 0.9020 |
13 | STZ | 0.8992 |
14 | AC2 | 0.8989 |
15 | Q9P | 0.8972 |
16 | DEG | 0.8958 |
17 | GDL | 0.8944 |
18 | PLP | 0.8936 |
19 | S8D | 0.8933 |
20 | G6P | 0.8928 |
21 | LTM | 0.8927 |
22 | PW1 | 0.8905 |
23 | 4WF | 0.8905 |
24 | K3Q | 0.8902 |
25 | TL6 | 0.8897 |
26 | L21 | 0.8887 |
27 | NDG | 0.8885 |
28 | MPP | 0.8884 |
29 | PMP | 0.8884 |
30 | EBQ | 0.8884 |
31 | TXW | 0.8879 |
32 | 327 | 0.8877 |
33 | 2K8 | 0.8874 |
34 | ZZZ | 0.8872 |
35 | PLR | 0.8851 |
36 | BG6 | 0.8848 |
37 | GPM | 0.8842 |
38 | NIP | 0.8839 |
39 | TLE | 0.8836 |
40 | M02 | 0.8832 |
41 | QUB | 0.8831 |
42 | 3LJ | 0.8827 |
43 | GLP | 0.8823 |
44 | PXP | 0.8813 |
45 | OSB | 0.8810 |
46 | GFP | 0.8806 |
47 | MW5 | 0.8804 |
48 | F6P | 0.8804 |
49 | GC2 | 0.8797 |
50 | KG1 | 0.8794 |
51 | G1P | 0.8794 |
52 | 4R1 | 0.8787 |
53 | SJK | 0.8787 |
54 | ZEA | 0.8786 |
55 | Z25 | 0.8781 |
56 | SIZ | 0.8780 |
57 | MJ5 | 0.8778 |
58 | JVN | 0.8761 |
59 | JVA | 0.8760 |
60 | CX4 | 0.8753 |
61 | RVE | 0.8753 |
62 | JV4 | 0.8752 |
63 | M01 | 0.8751 |
64 | 9R5 | 0.8750 |
65 | FPL | 0.8747 |
66 | PYU | 0.8746 |
67 | ZIP | 0.8745 |
68 | CH8 | 0.8738 |
69 | K82 | 0.8735 |
70 | ONZ | 0.8721 |
71 | 3RI | 0.8720 |
72 | 9VZ | 0.8720 |
73 | C6Z | 0.8719 |
74 | 4KR | 0.8718 |
75 | JD7 | 0.8715 |
76 | HVE | 0.8715 |
77 | D87 | 0.8715 |
78 | 2KU | 0.8712 |
79 | DCZ | 0.8709 |
80 | 3TC | 0.8708 |
81 | H4B | 0.8706 |
82 | XQI | 0.8706 |
83 | BEU | 0.8704 |
84 | 14W | 0.8703 |
85 | GI1 | 0.8697 |
86 | BDI | 0.8695 |
87 | E9P | 0.8686 |
88 | C9E | 0.8682 |
89 | GI4 | 0.8679 |
90 | 2JX | 0.8667 |
91 | GI2 | 0.8656 |
92 | TH4 | 0.8655 |
93 | M1P | 0.8649 |
94 | ASC | 0.8647 |
95 | AMR | 0.8646 |
96 | 27K | 0.8646 |
97 | B23 | 0.8641 |
98 | C09 | 0.8639 |
99 | X04 | 0.8629 |
100 | 67Y | 0.8624 |
101 | WL3 | 0.8624 |
102 | ZYC | 0.8620 |
103 | CHQ | 0.8619 |
104 | IOP | 0.8618 |
105 | LOG | 0.8608 |
106 | 6Q3 | 0.8608 |
107 | TLG | 0.8602 |
108 | 9KZ | 0.8598 |
109 | A4V | 0.8598 |
110 | I2E | 0.8597 |
111 | 6HP | 0.8596 |
112 | EYY | 0.8593 |
113 | DEW | 0.8590 |
114 | BQ2 | 0.8587 |
115 | QIF | 0.8584 |
116 | 9VQ | 0.8582 |
117 | F34 | 0.8576 |
118 | BGP | 0.8566 |
119 | SLC | 0.8553 |
120 | B5A | 0.8552 |
121 | 3JM | 0.8543 |
122 | Q5M | 0.8533 |