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- Structure Biounit | Ligand Information
- PDB : .ZIP | .CSV
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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 | 2XSR | - | PIE | C43 H80 O13 P | CCCCCCCCCC.... |
2 | 2XSV | - | PIE | C43 H80 O13 P | CCCCCCCCCC.... |
3 | 2XSU | - | PIE | C43 H80 O13 P | CCCCCCCCCC.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 225 families. | |||||
1 | 1DMH | - | LIO | C33 H67 N O8 P | CCCCCCCCCC.... |
2 | 1DLQ | - | LIO | C33 H67 N O8 P | CCCCCCCCCC.... |
3 | 1DLT | - | LIO | C33 H67 N O8 P | CCCCCCCCCC.... |
4 | 2XSR | - | PIE | C43 H80 O13 P | CCCCCCCCCC.... |
5 | 2XSV | - | PIE | C43 H80 O13 P | CCCCCCCCCC.... |
6 | 2XSU | - | PIE | C43 H80 O13 P | CCCCCCCCCC.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | PIE | 1 | 1 |
2 | B7N | 0.768293 | 0.94 |
3 | D21 | 0.670886 | 0.784314 |
4 | P3A | 0.659091 | 0.823529 |
5 | PII | 0.658537 | 0.92 |
6 | POV | 0.655172 | 0.661017 |
7 | LBN | 0.655172 | 0.661017 |
8 | L9R | 0.655172 | 0.661017 |
9 | LOP | 0.647059 | 0.666667 |
10 | 6OU | 0.647059 | 0.666667 |
11 | L9Q | 0.647059 | 0.666667 |
12 | RXY | 0.639535 | 0.666667 |
13 | T7X | 0.634409 | 0.94 |
14 | PCW | 0.625 | 0.645161 |
15 | D3D | 0.62069 | 0.788462 |
16 | PGW | 0.62069 | 0.788462 |
17 | DR9 | 0.613636 | 0.788462 |
18 | ZPE | 0.613636 | 0.666667 |
19 | PGV | 0.613636 | 0.788462 |
20 | P6L | 0.606742 | 0.788462 |
21 | OZ2 | 0.6 | 0.788462 |
22 | P50 | 0.6 | 0.689655 |
23 | CDL | 0.597561 | 0.795918 |
24 | GP7 | 0.591398 | 0.666667 |
25 | PX2 | 0.589744 | 0.78 |
26 | PX8 | 0.589744 | 0.78 |
27 | PA8 | 0.576923 | 0.78 |
28 | 1O2 | 0.574468 | 0.703704 |
29 | PG8 | 0.571429 | 0.803922 |
30 | DLP | 0.568421 | 0.661017 |
31 | 3TF | 0.568421 | 0.703704 |
32 | PIF | 0.568182 | 0.901961 |
33 | PSC | 0.5625 | 0.645161 |
34 | PIZ | 0.56044 | 0.882353 |
35 | 3PH | 0.556962 | 0.764706 |
36 | LPP | 0.556962 | 0.764706 |
37 | 6PH | 0.556962 | 0.764706 |
38 | F57 | 0.556962 | 0.764706 |
39 | 7PH | 0.556962 | 0.764706 |
40 | MC3 | 0.551724 | 0.644068 |
41 | PCF | 0.551724 | 0.644068 |
42 | PC1 | 0.551724 | 0.644068 |
43 | 7P9 | 0.55 | 0.764706 |
44 | 52N | 0.549451 | 0.901961 |
45 | IP9 | 0.549451 | 0.882353 |
46 | PIO | 0.549451 | 0.901961 |
47 | PTY | 0.541176 | 0.65 |
48 | 3PE | 0.541176 | 0.65 |
49 | PEF | 0.541176 | 0.65 |
50 | 8PE | 0.541176 | 0.65 |
51 | PEH | 0.541176 | 0.65 |
52 | PEV | 0.541176 | 0.65 |
53 | AGA | 0.54023 | 0.803922 |
54 | PEK | 0.536842 | 0.666667 |
55 | 9PE | 0.534884 | 0.65 |
56 | CD4 | 0.529412 | 0.764706 |
57 | 1L2 | 0.529412 | 0.703704 |
58 | 6PL | 0.522727 | 0.629032 |
59 | PC7 | 0.522727 | 0.629032 |
60 | HGP | 0.522727 | 0.629032 |
61 | PX4 | 0.522727 | 0.629032 |
62 | HGX | 0.522727 | 0.629032 |
63 | LIO | 0.522727 | 0.629032 |
64 | PLD | 0.522727 | 0.629032 |
65 | EPH | 0.519608 | 0.666667 |
66 | PGT | 0.517241 | 0.769231 |
67 | PEE | 0.517241 | 0.666667 |
68 | LHG | 0.517241 | 0.769231 |
69 | TGL | 0.513514 | 0.604167 |
70 | PD7 | 0.5125 | 0.764706 |
71 | P5S | 0.505618 | 0.689655 |
72 | GGD | 0.504673 | 0.709091 |
73 | M7U | 0.5 | 0.764706 |
74 | 8SP | 0.494382 | 0.689655 |
75 | CN3 | 0.483871 | 0.764706 |
76 | XP5 | 0.483146 | 0.629032 |
77 | NKP | 0.476744 | 0.75 |
78 | DGG | 0.474747 | 0.792453 |
79 | 44E | 0.469136 | 0.764706 |
80 | PCK | 0.464646 | 0.6 |
81 | CN6 | 0.462366 | 0.764706 |
82 | PGK | 0.459184 | 0.727273 |
83 | 42H | 0.447917 | 0.650794 |
84 | DGD | 0.446602 | 0.690909 |
85 | HXG | 0.444444 | 0.629032 |
86 | SQD | 0.444444 | 0.676923 |
87 | 44G | 0.438202 | 0.769231 |
88 | BQ9 | 0.430108 | 0.6 |
89 | PSF | 0.428571 | 0.689655 |
90 | S12 | 0.42268 | 0.689655 |
91 | PGM | 0.404494 | 0.784314 |
92 | 5P5 | 0.4 | 0.843137 |
93 | PIB | 0.4 | 0.843137 |
No: | Ligand | Similarity coefficient |
---|
This union binding pocket(no: 1) in the query (biounit: 2xsu.bio1) has 29 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
1 | 6LM1 | OCT | 10.6796 |
2 | 6LM1 | D10 | 10.6796 |
This union binding pocket(no: 2) in the query (biounit: 2xsu.bio1) has 29 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |