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No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 3 families. | |||||
1 | 6KZ8 | - | PA8 | C19 H36 O8 P | CCCCCCCC(=.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 3 families. | |||||
1 | 6KZ8 | - | PA8 | C19 H36 O8 P | CCCCCCCC(=.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | PA8 | 1 | 1 |
2 | PX2 | 0.980392 | 1 |
3 | PX8 | 0.980392 | 1 |
4 | LPP | 0.785714 | 0.930233 |
5 | 7PH | 0.785714 | 0.930233 |
6 | F57 | 0.785714 | 0.930233 |
7 | 3PH | 0.785714 | 0.930233 |
8 | 6PH | 0.785714 | 0.930233 |
9 | 7P9 | 0.77193 | 0.930233 |
10 | PD7 | 0.75 | 0.930233 |
11 | CD4 | 0.725806 | 0.930233 |
12 | CDL | 0.714286 | 0.928571 |
13 | TGL | 0.711538 | 0.707317 |
14 | PG8 | 0.703125 | 0.888889 |
15 | 3PE | 0.6875 | 0.769231 |
16 | PEV | 0.6875 | 0.769231 |
17 | 8PE | 0.6875 | 0.769231 |
18 | PEH | 0.6875 | 0.769231 |
19 | PTY | 0.6875 | 0.769231 |
20 | PEF | 0.6875 | 0.769231 |
21 | 44E | 0.684211 | 0.930233 |
22 | PGT | 0.676923 | 0.888889 |
23 | 9PE | 0.676923 | 0.769231 |
24 | LHG | 0.676923 | 0.888889 |
25 | M7U | 0.676923 | 0.930233 |
26 | PEE | 0.676923 | 0.788462 |
27 | D21 | 0.676923 | 0.909091 |
28 | 8SP | 0.666667 | 0.784314 |
29 | PC7 | 0.656716 | 0.773585 |
30 | LIO | 0.656716 | 0.773585 |
31 | PX4 | 0.656716 | 0.773585 |
32 | AGA | 0.656716 | 0.888889 |
33 | P5S | 0.656716 | 0.784314 |
34 | HGP | 0.656716 | 0.773585 |
35 | HGX | 0.656716 | 0.773585 |
36 | 6PL | 0.656716 | 0.773585 |
37 | PLD | 0.656716 | 0.773585 |
38 | MC3 | 0.647059 | 0.730769 |
39 | PCF | 0.647059 | 0.730769 |
40 | PC1 | 0.647059 | 0.730769 |
41 | CN3 | 0.642857 | 0.930233 |
42 | PII | 0.637681 | 0.816327 |
43 | XP5 | 0.626866 | 0.773585 |
44 | PIF | 0.619718 | 0.8 |
45 | CN6 | 0.614286 | 0.930233 |
46 | FAW | 0.603448 | 0.714286 |
47 | DGA | 0.603448 | 0.714286 |
48 | L2C | 0.603448 | 0.714286 |
49 | 1EM | 0.603448 | 0.714286 |
50 | DDR | 0.603448 | 0.714286 |
51 | 6OU | 0.60274 | 0.754717 |
52 | L9Q | 0.60274 | 0.754717 |
53 | LOP | 0.60274 | 0.754717 |
54 | IP9 | 0.594595 | 0.816327 |
55 | D3D | 0.594595 | 0.869565 |
56 | PGW | 0.594595 | 0.869565 |
57 | RXY | 0.594595 | 0.754717 |
58 | 52N | 0.594595 | 0.8 |
59 | PIO | 0.594595 | 0.8 |
60 | 44G | 0.590909 | 0.888889 |
61 | DR9 | 0.586667 | 0.869565 |
62 | PIZ | 0.586667 | 0.816327 |
63 | PGV | 0.586667 | 0.869565 |
64 | P6L | 0.578947 | 0.869565 |
65 | PCW | 0.578947 | 0.759259 |
66 | PGK | 0.578947 | 0.833333 |
67 | P3A | 0.576923 | 0.869565 |
68 | PIE | 0.576923 | 0.78 |
69 | HXG | 0.573529 | 0.773585 |
70 | PSF | 0.573529 | 0.784314 |
71 | POV | 0.571429 | 0.716981 |
72 | L9R | 0.571429 | 0.716981 |
73 | OZ2 | 0.571429 | 0.869565 |
74 | P50 | 0.571429 | 0.784314 |
75 | LBN | 0.571429 | 0.716981 |
76 | ZPE | 0.565789 | 0.754717 |
77 | PCK | 0.564103 | 0.732143 |
78 | B7N | 0.564103 | 0.8 |
79 | DGG | 0.556962 | 0.833333 |
80 | GP7 | 0.54321 | 0.754717 |
81 | LBR | 0.538462 | 0.659091 |
82 | PEK | 0.5375 | 0.754717 |
83 | PSC | 0.53012 | 0.759259 |
84 | NKO | 0.507937 | 0.886364 |
85 | NKN | 0.507937 | 0.886364 |
86 | PDK | 0.505618 | 0.666667 |
87 | T7X | 0.5 | 0.8 |
88 | G2A | 0.5 | 0.636364 |
89 | DLP | 0.5 | 0.716981 |
90 | 2JT | 0.5 | 0.636364 |
91 | LPX | 0.485714 | 0.75 |
92 | PGM | 0.478261 | 0.866667 |
93 | 3PC | 0.466667 | 0.711538 |
94 | 1QW | 0.466667 | 0.622222 |
95 | BQ9 | 0.466667 | 0.697674 |
96 | GYM | 0.466667 | 0.622222 |
97 | EKG | 0.466667 | 0.622222 |
98 | K6G | 0.465753 | 0.745455 |
99 | LAP | 0.465753 | 0.745455 |
100 | LPC | 0.465753 | 0.745455 |
101 | LP3 | 0.465753 | 0.745455 |
102 | EPH | 0.450549 | 0.754717 |
103 | NKP | 0.444444 | 0.866667 |
104 | PC5 | 0.432432 | 0.642857 |
105 | OCB | 0.424242 | 0.603774 |
106 | DAO FTT | 0.424242 | 0.609756 |
107 | CN5 | 0.421053 | 0.909091 |
108 | 42H | 0.414634 | 0.732143 |
109 | NTK | 0.410714 | 0.634146 |
110 | 87O | 0.40678 | 0.75 |
111 | PVC | 0.405797 | 0.604167 |
112 | OLC | 0.405797 | 0.608696 |
113 | OLB | 0.405797 | 0.608696 |
114 | S12 | 0.402439 | 0.75 |
No: | Ligand | Similarity coefficient |
---|
This union binding pocket(no: 1) in the query (biounit: 6kz8.bio1) has 21 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 6kz8.bio2) has 22 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |