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- Structure Biounit | Ligand Information
- PDB : .ZIP | .CSV
- Family 90% : .ZIP | .CSV
- Class : .ZIP | .CSV
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1 families. | |||||
1 | 2WF8 | - | BG6 | C6 H13 O9 P | C([C@@H]1[.... |
2 | 5OLY | - | G6P MGF | n/a | n/a |
3 | 2WF9 | - | BG6 | C6 H13 O9 P | C([C@@H]1[.... |
4 | 4C4R | Kd = 1.3 mM | YO5 | C7 H15 O8 P | C([C@@H]1[.... |
5 | 6YDM | - | CIT | C6 H8 O7 | C(C(=O)O)C.... |
6 | 1Z4O | Ki = 30 uM | GL1 | C6 H13 O9 P | C([C@@H]1[.... |
7 | 5OLX | - | BG6 MGF | n/a | n/a |
8 | 2WF5 | - | BG6 MGF | n/a | n/a |
9 | 4C4S | Kd = 0.66 mM | GRX | C7 H14 F O8 P | C([C@@H]1[.... |
10 | 6YDJ | - | BG6 | C6 H13 O9 P | C([C@@H]1[.... |
11 | 4C4T | - | GRX | C7 H14 F O8 P | C([C@@H]1[.... |
12 | 1O03 | - | G16 | C6 H13 O12 P2 | C([C@@H]1[.... |
13 | 1Z4N | Ki = 30 uM | GL1 | C6 H13 O9 P | C([C@@H]1[.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1 families. | |||||
1 | 2WF8 | - | BG6 | C6 H13 O9 P | C([C@@H]1[.... |
2 | 5OLY | - | G6P MGF | n/a | n/a |
3 | 2WF9 | - | BG6 | C6 H13 O9 P | C([C@@H]1[.... |
4 | 4C4R | Kd = 1.3 mM | YO5 | C7 H15 O8 P | C([C@@H]1[.... |
5 | 6YDM | - | CIT | C6 H8 O7 | C(C(=O)O)C.... |
6 | 1Z4O | Ki = 30 uM | GL1 | C6 H13 O9 P | C([C@@H]1[.... |
7 | 5OLX | - | BG6 MGF | n/a | n/a |
8 | 2WF5 | - | BG6 MGF | n/a | n/a |
9 | 4C4S | Kd = 0.66 mM | GRX | C7 H14 F O8 P | C([C@@H]1[.... |
10 | 6YDJ | - | BG6 | C6 H13 O9 P | C([C@@H]1[.... |
11 | 4C4T | - | GRX | C7 H14 F O8 P | C([C@@H]1[.... |
12 | 1O03 | - | G16 | C6 H13 O12 P2 | C([C@@H]1[.... |
13 | 1Z4N | Ki = 30 uM | GL1 | C6 H13 O9 P | C([C@@H]1[.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | GL1 | 1 | 1 |
2 | XGP | 1 | 1 |
3 | M1P | 1 | 1 |
4 | G1P | 1 | 1 |
5 | R1P | 0.852941 | 0.904762 |
6 | JV4 | 0.675 | 0.904762 |
7 | GFP | 0.533333 | 0.909091 |
8 | GP1 | 0.533333 | 0.833333 |
9 | RI2 | 0.533333 | 0.837209 |
10 | MBG | 0.512195 | 0.674419 |
11 | AMG | 0.512195 | 0.674419 |
12 | GYP | 0.512195 | 0.674419 |
13 | MMA | 0.512195 | 0.674419 |
14 | G16 | 0.5 | 0.928571 |
15 | NG1 | 0.480769 | 0.754717 |
16 | GN1 | 0.480769 | 0.754717 |
17 | BGC XGP | 0.472727 | 0.863636 |
18 | MAN IPD MAN | 0.471698 | 0.863636 |
19 | IPD MAN | 0.462963 | 0.904762 |
20 | GLC G6P | 0.461538 | 0.863636 |
21 | BQZ | 0.456522 | 0.707317 |
22 | YO5 | 0.454545 | 0.883721 |
23 | GPM | 0.454545 | 0.883721 |
24 | 2M8 | 0.44 | 0.714286 |
25 | BNX | 0.434783 | 1 |
26 | ALX | 0.434783 | 1 |
27 | GMB | 0.433962 | 0.928571 |
28 | 56N | 0.431373 | 0.697674 |
29 | RGG | 0.428571 | 0.690476 |
30 | GAT | 0.423077 | 0.6 |
31 | MK0 | 0.42029 | 0.75 |
32 | DEG | 0.42 | 0.617021 |
33 | GAL PHB | 0.418182 | 0.681818 |
34 | GLC U8V | 0.418182 | 0.652174 |
35 | MMA MAN | 0.415094 | 0.666667 |
36 | GPM GLC | 0.413793 | 0.844444 |
37 | MBG GLA | 0.411765 | 0.666667 |
38 | BGC GLA GAL | 0.411765 | 0.697674 |
39 | BGC GLC GLC GLC GLC GLC | 0.407407 | 0.697674 |
40 | BGC GLC GLC GLC GLC | 0.407407 | 0.697674 |
41 | J5B | 0.403846 | 0.630435 |
42 | GAL GLA | 0.403846 | 0.697674 |
43 | EBQ | 0.403846 | 0.630435 |
44 | FUC GAL | 0.4 | 0.697674 |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | IPT | 0.9189 |
2 | NBG | 0.9086 |
3 | JVA | 0.9081 |
4 | 9KH | 0.9029 |
5 | 790 | 0.8971 |
6 | GC2 | 0.8957 |
7 | M3Q | 0.8949 |
8 | GRX | 0.8948 |
9 | G6P | 0.8940 |
10 | BG6 | 0.8940 |
11 | HSX | 0.8937 |
12 | X1P | 0.8932 |
13 | 57O | 0.8932 |
14 | LIP | 0.8931 |
15 | S3P | 0.8929 |
16 | CSN | 0.8917 |
17 | IPD | 0.8916 |
18 | 7WR | 0.8876 |
19 | GCU | 0.8860 |
20 | IBM | 0.8840 |
21 | QMS | 0.8829 |
22 | CCV | 0.8810 |
23 | 67Y | 0.8797 |
24 | I4D | 0.8793 |
25 | KED | 0.8791 |
26 | BDP | 0.8789 |
27 | BGC | 0.8780 |
28 | XQI | 0.8780 |
29 | FXH | 0.8773 |
30 | 2O6 | 0.8772 |
31 | GCB | 0.8771 |
32 | EVA | 0.8764 |
33 | IOS | 0.8764 |
34 | FHN | 0.8758 |
35 | RP5 | 0.8757 |
36 | BGP | 0.8757 |
37 | 6DP | 0.8754 |
38 | CR1 | 0.8754 |
39 | SRO | 0.8750 |
40 | GNL | 0.8744 |
41 | NSG | 0.8744 |
42 | TQU | 0.8741 |
43 | GLC | 0.8735 |
44 | ZON | 0.8733 |
45 | SG2 | 0.8731 |
46 | EXD | 0.8729 |
47 | UFV | 0.8727 |
48 | 3LJ | 0.8723 |
49 | KG1 | 0.8716 |
50 | 512 | 0.8714 |
51 | GOX | 0.8709 |
52 | 7FF | 0.8704 |
53 | NLA | 0.8704 |
54 | NAG | 0.8701 |
55 | ALN | 0.8696 |
56 | T6Z | 0.8686 |
57 | 8U3 | 0.8685 |
58 | NPA | 0.8682 |
59 | HPT | 0.8679 |
60 | 3RI | 0.8677 |
61 | IAC | 0.8671 |
62 | DNC | 0.8669 |
63 | 15A | 0.8663 |
64 | MP5 | 0.8657 |
65 | VYM | 0.8648 |
66 | XH2 | 0.8646 |
67 | IFG | 0.8645 |
68 | 505 | 0.8643 |
69 | TRP | 0.8642 |
70 | OMD | 0.8636 |
71 | KGK | 0.8632 |
72 | P84 | 0.8631 |
73 | I59 | 0.8630 |
74 | TSR | 0.8630 |
75 | SBK | 0.8629 |
76 | FWD | 0.8628 |
77 | NGO | 0.8625 |
78 | 7I2 | 0.8624 |
79 | CWD | 0.8623 |
80 | 9GP | 0.8613 |
81 | K3Q | 0.8611 |
82 | TRF | 0.8609 |
83 | MUR | 0.8608 |
84 | PRZ | 0.8602 |
85 | L7T | 0.8598 |
86 | TNX | 0.8596 |
87 | GCS | 0.8595 |
88 | ESI | 0.8595 |
89 | F6P | 0.8595 |
90 | GT0 | 0.8594 |
91 | NGT | 0.8590 |
92 | 5OF | 0.8590 |
93 | APS | 0.8590 |
94 | LZ2 | 0.8588 |
95 | 9F8 | 0.8585 |
96 | GLG | 0.8579 |
97 | JF2 | 0.8578 |
98 | F52 | 0.8576 |
99 | SYR | 0.8574 |
100 | GL2 | 0.8568 |
101 | IOP | 0.8565 |
102 | 9BF | 0.8561 |
103 | KWQ | 0.8547 |
104 | DTR | 0.8545 |
105 | 5RP | 0.8542 |
106 | FA3 | 0.8537 |
This union binding pocket(no: 1) in the query (biounit: 1z4o.bio2) has 18 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 1z4o.bio1) has 25 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |