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No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 5 families. | |||||
1 | 3ST6 | Ki = 240 uM | RVE | C10 H8 O6 | C=C(C(=O)O.... |
2 | 6ZA4 | ic50 = 6.3 uM | M83 | C12 H7 N O3 | c1cc(cc(c1.... |
3 | 3RV6 | Ki = 21 uM | RVA | C16 H12 O6 | c1ccc(cc1).... |
4 | 3RV9 | Ki = 12 uM | RVD | C12 H12 O6 | CC/C=C(/C(.... |
5 | 3RV7 | Ki = 14 uM | RVB | C13 H14 O6 | CC(C)/C=C(.... |
6 | 2G5F | - | PYR | C3 H4 O3 | CC(=O)C(=O.... |
7 | 3VEH | Ki = 11 uM | 0GA | C11 H10 O6 | C/C=C(/C(=.... |
8 | 6ZA5 | - | SAL | C7 H6 O3 | c1ccc(c(c1.... |
9 | 3LOG | - | SIN | C4 H6 O4 | C(CC(=O)O).... |
10 | 3RV8 | Ki = 12 uM | RVC | C13 H12 O6 | c1cc(c(c(c.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 4 families. | |||||
1 | 2FN1 | - | PYR | C3 H4 O3 | CC(=O)C(=O.... |
2 | 3ST6 | Ki = 240 uM | RVE | C10 H8 O6 | C=C(C(=O)O.... |
3 | 6ZA4 | ic50 = 6.3 uM | M83 | C12 H7 N O3 | c1cc(cc(c1.... |
4 | 3RV6 | Ki = 21 uM | RVA | C16 H12 O6 | c1ccc(cc1).... |
5 | 3RV9 | Ki = 12 uM | RVD | C12 H12 O6 | CC/C=C(/C(.... |
6 | 3RV7 | Ki = 14 uM | RVB | C13 H14 O6 | CC(C)/C=C(.... |
7 | 2G5F | - | PYR | C3 H4 O3 | CC(=O)C(=O.... |
8 | 3VEH | Ki = 11 uM | 0GA | C11 H10 O6 | C/C=C(/C(=.... |
9 | 6ZA5 | - | SAL | C7 H6 O3 | c1ccc(c(c1.... |
10 | 3LOG | - | SIN | C4 H6 O4 | C(CC(=O)O).... |
11 | 3RV8 | Ki = 12 uM | RVC | C13 H12 O6 | c1cc(c(c(c.... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | FMC | 0.9231 |
2 | 3AD | 0.9220 |
3 | MZR | 0.9179 |
4 | PUR | 0.9162 |
5 | TBN | 0.9133 |
6 | TRP | 0.9130 |
7 | DUR | 0.9116 |
8 | LDC | 0.9115 |
9 | 7D7 | 0.9111 |
10 | AD3 | 0.9090 |
11 | 5N5 | 0.9089 |
12 | 5FD | 0.9085 |
13 | ADN | 0.9084 |
14 | A | 0.9084 |
15 | 1DA | 0.9074 |
16 | 5CD | 0.9071 |
17 | 9DI | 0.9071 |
18 | A4D | 0.9070 |
19 | NOS | 0.9060 |
20 | FMB | 0.9058 |
21 | 5AD | 0.9056 |
22 | DBS | 0.9030 |
23 | DTR | 0.9023 |
24 | H7S | 0.9004 |
25 | TIZ | 0.8998 |
26 | 8OX | 0.8990 |
27 | HPR | 0.8973 |
28 | PRH | 0.8973 |
29 | 5UD | 0.8966 |
30 | 5ID | 0.8961 |
31 | MTA | 0.8935 |
32 | PZ8 | 0.8929 |
33 | 5F1 | 0.8928 |
34 | ARJ | 0.8922 |
35 | RBV | 0.8912 |
36 | 3TC | 0.8910 |
37 | 4E5 | 0.8905 |
38 | B2T | 0.8886 |
39 | LLT | 0.8886 |
40 | RAB | 0.8884 |
41 | TAL | 0.8884 |
42 | J47 | 0.8876 |
43 | ZIQ | 0.8870 |
44 | 3D1 | 0.8868 |
45 | 6MD | 0.8868 |
46 | 7QV | 0.8857 |
47 | MDR | 0.8856 |
48 | Y3J | 0.8854 |
49 | NOC | 0.8853 |
50 | 7R7 | 0.8852 |
51 | MTP | 0.8850 |
52 | DCZ | 0.8843 |
53 | FM2 | 0.8841 |
54 | 0J2 | 0.8828 |
55 | ACK | 0.8818 |
56 | RFZ | 0.8816 |
57 | 5MD | 0.8816 |
58 | THU | 0.8811 |
59 | 2FA | 0.8810 |
60 | FM1 | 0.8808 |
61 | 3L1 | 0.8806 |
62 | CTN | 0.8805 |
63 | ETV | 0.8805 |
64 | EXR | 0.8802 |
65 | JGM | 0.8800 |
66 | IMH | 0.8798 |
67 | A8Q | 0.8788 |
68 | JOB | 0.8782 |
69 | THM | 0.8780 |
70 | ID8 | 0.8778 |
71 | NWW | 0.8777 |
72 | GMP | 0.8771 |
73 | A4Q | 0.8771 |
74 | JO5 | 0.8758 |
75 | LTT | 0.8758 |
76 | UUA | 0.8757 |
77 | ZEB | 0.8756 |
78 | 5I5 | 0.8744 |
79 | 4UO | 0.8741 |
80 | 2GD | 0.8731 |
81 | RPN | 0.8725 |
82 | 3BH | 0.8723 |
83 | 2B4 | 0.8715 |
84 | M0N | 0.8714 |
85 | 1A5 | 0.8711 |
86 | 38B | 0.8709 |
87 | A4B | 0.8706 |
88 | CC5 | 0.8706 |
89 | CTE | 0.8704 |
90 | 5BT | 0.8704 |
91 | EF2 | 0.8689 |
92 | AFX | 0.8687 |
93 | 1SF | 0.8681 |
94 | 79W | 0.8676 |
95 | HBI | 0.8669 |
96 | EAJ | 0.8669 |
97 | DTE | 0.8659 |
98 | 9FH | 0.8644 |
99 | CFE | 0.8633 |
100 | W23 | 0.8632 |
101 | Z17 | 0.8629 |
102 | 0DN | 0.8618 |
103 | 2FD | 0.8611 |
104 | 6J3 | 0.8601 |
105 | X6P | 0.8598 |
106 | DNB | 0.8584 |
107 | KCH | 0.8573 |
108 | DIF | 0.8551 |
109 | SNI | 0.8549 |
110 | WVV | 0.8545 |
111 | DDU | 0.8544 |
112 | 3NF | 0.8533 |
This union binding pocket(no: 1) in the query (biounit: 6za4.bio3) has 20 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 6za4.bio1) has 40 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
1 | 1I7Q | PYR | 26.1062 |
2 | 1I7Q | PYR | 26.1062 |
This union binding pocket(no: 3) in the query (biounit: 6za4.bio2) has 30 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
1 | 3R75 | PYR | 23.4513 |
This union binding pocket(no: 4) in the query (biounit: 6za4.bio4) has 22 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |