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No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 10 families. | |||||
1 | 2CYB | - | TYR | C9 H11 N O3 | c1cc(ccc1C.... |
2 | 4NX2 | - | 2LT | C9 H9 Cl2 N O3 | c1c(cc(c(c.... |
3 | 3QE4 | - | 4CF | C10 H10 N2 O2 | c1cc(ccc1C.... |
4 | 4NDA | - | NIY | C9 H10 N2 O5 | c1cc(c(cc1.... |
5 | 3D6V | - | TFQ | C11 H12 F3 N O2 | c1cc(ccc1C.... |
6 | 2AG6 | - | 4BF | C9 H10 Br N O2 | c1cc(ccc1C.... |
7 | 3D6U | - | T11 | C11 H12 F3 N3 O2 | c1cc(ccc1C.... |
8 | 4PBT | - | 2LQ | C18 H24 N2 O3 | c1cc(ccc1C.... |
9 | 5N5U | - | AMP | C10 H14 N5 O7 P | c1nc(c2c(n.... |
10 | 2HGZ | - | PBF | C16 H15 N O3 | c1ccc(cc1).... |
11 | 4PBR | - | 2L7 | C13 H17 Br N2 O3 | CC(C)(C(=O.... |
12 | 5L7P | - | BUU | C16 H16 N2 O6 | c1ccc(c(c1.... |
13 | 2PXH | - | BP5 | C13 H13 N3 O2 | c1ccnc(c1).... |
14 | 5NSF | - | 96Z | C13 H15 N O2 | C1C=CC2=CC.... |
15 | 3N2Y | - | TEF | C10 H11 N5 O2 | c1cc(ccc1C.... |
16 | 6WRN | - | NIY | C9 H10 N2 O5 | c1cc(c(cc1.... |
17 | 1ZH6 | - | 4AF | C11 H13 N O3 | CC(=O)c1cc.... |
18 | 4PBS | - | 2L7 | C13 H17 Br N2 O3 | CC(C)(C(=O.... |
19 | 6WRK | - | NIY | C9 H10 N2 O5 | c1cc(c(cc1.... |
20 | 1ZH0 | - | NAL | C13 H13 N O2 | c1ccc2cc(c.... |
21 | 6WRQ | - | NIY | C9 H10 N2 O5 | c1cc(c(cc1.... |
22 | 6WRT | - | NIY | C9 H10 N2 O5 | c1cc(c(cc1.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 4 families. | |||||
1 | 2CYB | - | TYR | C9 H11 N O3 | c1cc(ccc1C.... |
2 | 4NX2 | - | 2LT | C9 H9 Cl2 N O3 | c1c(cc(c(c.... |
3 | 3QE4 | - | 4CF | C10 H10 N2 O2 | c1cc(ccc1C.... |
4 | 4NDA | - | NIY | C9 H10 N2 O5 | c1cc(c(cc1.... |
5 | 3D6V | - | TFQ | C11 H12 F3 N O2 | c1cc(ccc1C.... |
6 | 2AG6 | - | 4BF | C9 H10 Br N O2 | c1cc(ccc1C.... |
7 | 3D6U | - | T11 | C11 H12 F3 N3 O2 | c1cc(ccc1C.... |
8 | 4PBT | - | 2LQ | C18 H24 N2 O3 | c1cc(ccc1C.... |
9 | 5N5U | - | AMP | C10 H14 N5 O7 P | c1nc(c2c(n.... |
10 | 2HGZ | - | PBF | C16 H15 N O3 | c1ccc(cc1).... |
11 | 4PBR | - | 2L7 | C13 H17 Br N2 O3 | CC(C)(C(=O.... |
12 | 5L7P | - | BUU | C16 H16 N2 O6 | c1ccc(c(c1.... |
13 | 2PXH | - | BP5 | C13 H13 N3 O2 | c1ccnc(c1).... |
14 | 5NSF | - | 96Z | C13 H15 N O2 | C1C=CC2=CC.... |
15 | 3N2Y | - | TEF | C10 H11 N5 O2 | c1cc(ccc1C.... |
16 | 6WRN | - | NIY | C9 H10 N2 O5 | c1cc(c(cc1.... |
17 | 1ZH6 | - | 4AF | C11 H13 N O3 | CC(=O)c1cc.... |
18 | 4PBS | - | 2L7 | C13 H17 Br N2 O3 | CC(C)(C(=O.... |
19 | 6WRK | - | NIY | C9 H10 N2 O5 | c1cc(c(cc1.... |
20 | 1ZH0 | - | NAL | C13 H13 N O2 | c1ccc2cc(c.... |
21 | 6WRQ | - | NIY | C9 H10 N2 O5 | c1cc(c(cc1.... |
22 | 6WRT | - | NIY | C9 H10 N2 O5 | c1cc(c(cc1.... |
23 | 2CYC | - | TYR | C9 H11 N O3 | c1cc(ccc1C.... |
24 | 1Q11 | - | TYE | C9 H13 N O2 | c1cc(ccc1C.... |
25 | 5THH | - | TYR | C9 H11 N O3 | c1cc(ccc1C.... |
26 | 3VGJ | - | TYR AMP | n/a | n/a |
27 | 2J5B | - | TYE | C9 H13 N O2 | c1cc(ccc1C.... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | TEF | 0.9634 |
2 | PB2 | 0.9455 |
3 | SYD | 0.9412 |
4 | D26 | 0.9243 |
5 | 3K1 | 0.9206 |
6 | KOH | 0.9204 |
7 | 5TT | 0.9199 |
8 | HPK | 0.9185 |
9 | RF2 | 0.9182 |
10 | BFL | 0.9145 |
11 | 7KE | 0.9144 |
12 | CT0 | 0.9126 |
13 | PTR | 0.9118 |
14 | 2L7 | 0.9115 |
15 | LC1 | 0.9112 |
16 | MKN | 0.9110 |
17 | Z3R | 0.9107 |
18 | CIU | 0.9088 |
19 | D25 | 0.9088 |
20 | 39R | 0.9083 |
21 | HDI | 0.9071 |
22 | S45 | 0.9067 |
23 | 4VC | 0.9060 |
24 | 2OX | 0.9045 |
25 | CR4 | 0.9044 |
26 | L02 | 0.9038 |
27 | 1OT | 0.9027 |
28 | BMZ | 0.9023 |
29 | 135 | 0.9022 |
30 | NNF | 0.9013 |
31 | 124 | 0.9002 |
32 | 120 | 0.8999 |
33 | E42 | 0.8991 |
34 | 801 | 0.8986 |
35 | J2P | 0.8974 |
36 | F91 | 0.8964 |
37 | 122 | 0.8951 |
38 | J2N | 0.8949 |
39 | 6NF | 0.8947 |
40 | TFX | 0.8941 |
41 | 0LA | 0.8939 |
42 | C0V | 0.8931 |
43 | SJR | 0.8930 |
44 | 4UE | 0.8915 |
45 | Y27 | 0.8912 |
46 | 20P | 0.8906 |
47 | 0MB | 0.8906 |
48 | 90M | 0.8901 |
49 | J3B | 0.8888 |
50 | TFQ | 0.8872 |
51 | 23M | 0.8871 |
52 | 6DH | 0.8871 |
53 | 90G | 0.8864 |
54 | HAU | 0.8857 |
55 | A5W | 0.8856 |
56 | 1CE | 0.8855 |
57 | 121 | 0.8854 |
58 | 651 | 0.8853 |
59 | LIT | 0.8851 |
60 | 5ET | 0.8844 |
61 | BCE | 0.8839 |
62 | M5A | 0.8835 |
63 | 1GV | 0.8834 |
64 | REG | 0.8832 |
65 | 20N | 0.8822 |
66 | 4ZW | 0.8814 |
67 | N0E | 0.8814 |
68 | 22M | 0.8813 |
69 | MI2 | 0.8809 |
70 | FTK | 0.8808 |
71 | 5OD | 0.8800 |
72 | 856 | 0.8798 |
73 | 35K | 0.8797 |
74 | F5N | 0.8797 |
75 | AZB | 0.8793 |
76 | AD6 | 0.8790 |
77 | 1Q1 | 0.8789 |
78 | 521 | 0.8783 |
79 | ZTW | 0.8779 |
80 | ZUF | 0.8778 |
81 | D9Q | 0.8778 |
82 | 109 | 0.8777 |
83 | GJG | 0.8776 |
84 | 47X | 0.8774 |
85 | RKY | 0.8766 |
86 | 246 | 0.8761 |
87 | 7N8 | 0.8760 |
88 | ESJ | 0.8744 |
89 | AT2 | 0.8742 |
90 | HTK | 0.8741 |
91 | 5OA | 0.8737 |
92 | U55 | 0.8731 |
93 | F41 | 0.8727 |
94 | 1PB | 0.8719 |
95 | JXA | 0.8719 |
96 | 0NJ | 0.8717 |
97 | 5EZ | 0.8713 |
98 | K4T | 0.8709 |
99 | HMO | 0.8707 |
100 | 4UM | 0.8707 |
101 | 397 | 0.8706 |
102 | M25 | 0.8700 |
103 | A8D | 0.8692 |
104 | JP5 | 0.8681 |
105 | BOS | 0.8674 |
106 | 077 | 0.8664 |
107 | K3T | 0.8656 |
108 | SQG | 0.8646 |
109 | JVB | 0.8643 |
110 | A11 | 0.8639 |
111 | EAA | 0.8631 |
112 | VGV | 0.8627 |
113 | GJW | 0.8617 |
114 | GBJ | 0.8614 |
115 | HMX | 0.8601 |
116 | 5XM | 0.8600 |
117 | 3G3 | 0.8587 |
118 | BON | 0.8573 |
119 | 789 | 0.8512 |
This union binding pocket(no: 1) in the query (biounit: 5n5u.bio1) has 50 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 5n5u.bio1) has 50 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 3) in the query (biounit: 5n5u.bio1) has 39 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 4) in the query (biounit: 5n5u.bio1) has 39 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |