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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 337 families. | |||||
1 | 6TO2 | Kd = 20 nM | NQ8 | C19 H30 O | C[C@@]12CC.... |
2 | 4J6C | - | STR | C21 H30 O2 | CC(=O)[C@H.... |
3 | 4JBT | - | ASD | C19 H26 O2 | C[C@]12CCC.... |
4 | 4J6B | - | PLO | C21 H32 O2 | CC(=O)[C@H.... |
5 | 4J6D | - | TES | C19 H28 O2 | C[C@]12CC[.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 14 families. | |||||
1 | 3A50 | - | VD3 | C27 H44 O | CC(C)CCC[C.... |
2 | 3A51 | - | VDY | C27 H44 O2 | C[C@H](CCC.... |
3 | 5FOI | Kd = 1 nM | MY8 | C29 H49 N O6 | CC[C@@H]1[.... |
4 | 5GWE | Kd = 62 uM | GWM | C7 H9 O4 P | Cc1ccc(cc1.... |
5 | 5XJN | - | 88L | C8 H11 O4 P | CCc1ccc(cc.... |
6 | 4OQR | Kd = 29.3 uM | 2UO | C23 H34 O5 | CC[C@H](C).... |
7 | 4UBS | Kd = 65 uM | DIF | C14 H11 Cl2 N O2 | c1ccc(c(c1.... |
8 | 5L1O | Kd = 7.2 uM | 7PF | C15 H18 O5 | CC1(C[C@H].... |
9 | 5L1U | Kd = 340 uM | 7PF | C15 H18 O5 | CC1(C[C@H].... |
10 | 5L1S | Kd = 160 uM | 7PF | C15 H18 O5 | CC1(C[C@H].... |
11 | 5L1V | Kd = 43 uM | 7PF | C15 H18 O5 | CC1(C[C@H].... |
12 | 5L1Q | Kd = 170 uM | 7DF | C15 H20 O5 | CC1(C[C@H].... |
13 | 5L1P | - | 7PT | C15 H16 O5 | C[C@H]1[C@.... |
14 | 2NZ5 | Kd = 10.5 uM | 226 | C10 H8 O5 | c1c(cc(c2c.... |
15 | 5IT1 | - | 2OH | C15 H16 O2 | CC(C)(c1cc.... |
16 | 2WI9 | Kd = 309 uM | 1D2 | C20 H39 N O3 | C[C@@H]1C[.... |
17 | 2VZM | Kd = 171.9 uM | NRB | C28 H47 N O7 | CC[C@@H]1[.... |
18 | 4B7S | Kd = 81 uM | QLE | C22 H37 N O5 | CC[C@@H]1[.... |
19 | 3ZK5 | Kd = 118 uM | Z18 | C21 H35 N O5 | CC[C@@H]1[.... |
20 | 5X7E | - | 7ZU | C28 H44 O3 | C[C@H](/C=.... |
21 | 2ZBZ | - | VDX | C27 H44 O3 | C[C@H](CCC.... |
22 | 3CV9 | - | VDX | C27 H44 O3 | C[C@H](CCC.... |
23 | 2XBK | Kd = 4 uM | XBK | C33 H47 N O12 | C[C@@H]1CC.... |
24 | 6ZI7 | - | QR8 | C20 H36 O6 | C[C@H]1C[C.... |
25 | 6ZHZ | - | QR8 | C20 H36 O6 | C[C@H]1C[C.... |
26 | 6ZI3 | - | DEB | C21 H38 O6 | CC[C@@H]1[.... |
27 | 6M4P | - | F4O | C40 H53 N O14 | Cc1c2c(c3c.... |
28 | 1Z8Q | - | DEB | C21 H38 O6 | CC[C@@H]1[.... |
29 | 1Z8P | - | DEB | C21 H38 O6 | CC[C@@H]1[.... |
30 | 1JIN | - | KTN | C26 H28 Cl2 N4 O4 | CC(=O)N1CC.... |
31 | 1JIO | - | DEB | C21 H38 O6 | CC[C@@H]1[.... |
32 | 1Z8O | - | DEB | C21 H38 O6 | CC[C@@H]1[.... |
33 | 1S1F | - | PIM | C9 H8 N2 | c1ccc(cc1).... |
34 | 2D09 | Kd = 7.3 uM | FLV | C10 H6 O5 | c1c(cc(c2c.... |
35 | 1T93 | - | FLV | C10 H6 O5 | c1c(cc(c2c.... |
36 | 2D0E | Kd = 43 uM | NQ | C10 H6 O3 | c1ccc2c(c1.... |
37 | 1XQD | Kd = 0.07 mM | DND | C21 H27 N6 O15 P2 | c1cc(c[n+].... |
38 | 6GK6 | Kd = 2.1 uM | MYR | C14 H28 O2 | CCCCCCCCCC.... |
39 | 5L91 | Kd = 91 uM | C0R | C21 H30 O4 | C[C@]12CCC.... |
40 | 5L94 | Kd = 105 uM | TES | C19 H28 O2 | C[C@]12CC[.... |
41 | 4AW3 | - | MYV | C37 H61 N O12 | CC[C@@H]1[.... |
42 | 2Y5N | - | MYV | C37 H61 N O12 | CC[C@@H]1[.... |
43 | 3ZSN | - | MIV | C37 H61 N O11 | CC[C@@H]1[.... |
44 | 2Y98 | - | MIV | C37 H61 N O11 | CC[C@@H]1[.... |
45 | 2Y5Z | - | ZM3 | C36 H59 N O11 | CC[C@@H]1[.... |
46 | 2YCA | - | ZM3 | C36 H59 N O11 | CC[C@@H]1[.... |
47 | 2Y46 | - | MIV | C37 H61 N O11 | CC[C@@H]1[.... |
48 | 3WVS | - | RRM | C32 H48 O7 | CCCC[C@H]1.... |
49 | 6TO2 | Kd = 20 nM | NQ8 | C19 H30 O | C[C@@]12CC.... |
50 | 4J6C | - | STR | C21 H30 O2 | CC(=O)[C@H.... |
51 | 4JBT | - | ASD | C19 H26 O2 | C[C@]12CCC.... |
52 | 4J6B | - | PLO | C21 H32 O2 | CC(=O)[C@H.... |
53 | 4J6D | - | TES | C19 H28 O2 | C[C@]12CC[.... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | AOM | 0.9975 |
2 | 5SD | 0.9967 |
3 | AOX | 0.9950 |
4 | DHT | 0.9936 |
5 | AOI | 0.9896 |
6 | ANO | 0.9851 |
7 | AON | 0.9791 |
8 | BDT | 0.9789 |
9 | NQ8 | 0.9778 |
10 | 6VW | 0.9711 |
11 | ESR | 0.9688 |
12 | R18 | 0.9543 |
13 | EST | 0.9528 |
14 | PLO | 0.9457 |
15 | EQU | 0.9426 |
16 | CI2 | 0.9407 |
17 | J3Z | 0.9398 |
18 | 17M | 0.9311 |
19 | NDR | 0.9304 |
20 | ESZ | 0.9164 |
21 | CUE | 0.9154 |
22 | ECS | 0.9099 |
23 | ESL | 0.9096 |
24 | 17H | 0.9094 |
25 | C0R | 0.9091 |
26 | NOG | 0.9088 |
27 | 1DR | 0.8957 |
28 | HCY | 0.8955 |
29 | CX6 | 0.8955 |
30 | AS4 | 0.8942 |
31 | GEN | 0.8940 |
32 | PDN | 0.8938 |
33 | 3WF | 0.8909 |
34 | PIQ | 0.8906 |
35 | 397 | 0.8884 |
36 | 1N7 | 0.8876 |
37 | 120 | 0.8859 |
38 | XYP XYP | 0.8857 |
39 | IXM | 0.8857 |
40 | K7H | 0.8853 |
41 | 272 | 0.8853 |
42 | EES | 0.8852 |
43 | DX2 | 0.8849 |
44 | 39Z | 0.8846 |
45 | ZK5 | 0.8837 |
46 | 801 | 0.8836 |
47 | SDN | 0.8831 |
48 | X2M | 0.8827 |
49 | 1FL | 0.8807 |
50 | 18E | 0.8806 |
51 | TUA | 0.8806 |
52 | 7G0 | 0.8802 |
53 | LFN | 0.8801 |
54 | ESM | 0.8800 |
55 | AP6 | 0.8797 |
56 | YZ9 | 0.8793 |
57 | PRL | 0.8792 |
58 | 8SK | 0.8789 |
59 | 0UL | 0.8786 |
60 | 9CE | 0.8775 |
61 | E6Q | 0.8775 |
62 | M3F | 0.8772 |
63 | 0FR | 0.8766 |
64 | ADL | 0.8751 |
65 | NDD | 0.8748 |
66 | 1V4 | 0.8744 |
67 | 4CN | 0.8740 |
68 | WLH | 0.8739 |
69 | ZSP | 0.8737 |
70 | 6BK | 0.8732 |
71 | 789 | 0.8732 |
72 | NRA | 0.8729 |
73 | RSV | 0.8729 |
74 | DEX | 0.8726 |
75 | 124 | 0.8723 |
76 | XYS XYS | 0.8722 |
77 | H4B | 0.8720 |
78 | Z94 | 0.8720 |
79 | DX7 | 0.8715 |
80 | MBT | 0.8713 |
81 | HNT | 0.8711 |
82 | XYS XYP | 0.8710 |
83 | EED | 0.8704 |
84 | LUM | 0.8703 |
85 | VUP | 0.8702 |
86 | 79X | 0.8696 |
87 | 6FB | 0.8690 |
88 | 2WU | 0.8689 |
89 | HH6 | 0.8689 |
90 | CR4 | 0.8687 |
91 | 5XL | 0.8668 |
92 | QNM | 0.8668 |
93 | WG8 | 0.8666 |
94 | S98 | 0.8660 |
95 | JOB | 0.8657 |
96 | RHN | 0.8652 |
97 | BMZ | 0.8649 |
98 | 1HP | 0.8645 |
99 | FT2 | 0.8644 |
100 | TUV | 0.8644 |
101 | WV7 | 0.8637 |
102 | 6DQ | 0.8633 |
103 | 0DF | 0.8629 |
104 | 6QT | 0.8624 |
105 | IQZ | 0.8620 |
106 | 20D | 0.8614 |
107 | BIO | 0.8612 |
108 | 1V8 | 0.8611 |
109 | 5OR | 0.8611 |
110 | Z21 | 0.8605 |
111 | V13 | 0.8598 |
112 | 1WO | 0.8598 |
113 | YE6 | 0.8595 |
114 | 0LA | 0.8592 |
115 | 5E5 | 0.8592 |
116 | 16G | 0.8588 |
117 | BIH | 0.8586 |
118 | CHQ | 0.8583 |
119 | Q0K | 0.8583 |
120 | AQN | 0.8579 |
121 | 5AD | 0.8576 |
122 | 9KZ | 0.8575 |
123 | F40 | 0.8567 |
124 | WS7 | 0.8566 |
125 | II4 | 0.8557 |
126 | 9OF | 0.8542 |
127 | 5VU | 0.8534 |
128 | 7G2 | 0.8533 |
129 | HRM | 0.8528 |
130 | HBI | 0.8522 |
131 | 3F4 | 0.8518 |
132 | 5ER | 0.8513 |
This union binding pocket(no: 1) in the query (biounit: 6to2.bio2) has 14 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 6to2.bio1) has 15 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |