- Navigate
- Expand All | Collapse All
- Receptor | Ligand | View in 3D
- Family: 90% | 70% | 50% | site
- External Links
- |
- Download
- 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 6 families. | |||||
1 | 1FWY | - | UD1 | C17 H27 N3 O17 P2 | CC(=O)N[C@.... |
2 | 2V0K | - | UDP | C9 H14 N2 O12 P2 | C1=CN(C(=O.... |
3 | 4E1K | Kd = 0.5 uM | 0N5 | C22 H18 N4 O3 | COc1cc2c(c.... |
4 | 4KNX | ic50 = 3.2 uM | 1S9 | C24 H20 N4 O5 | COc1cc2c(c.... |
5 | 4KPZ | - | 1SF | C10 H9 N3 O4 | c1cc(cc(c1.... |
6 | 2V0I | - | UD1 | C17 H27 N3 O17 P2 | CC(=O)N[C@.... |
7 | 2V0L | - | URI | C9 H12 N2 O6 | C1=CN(C(=O.... |
8 | 2V0J | - | H2U | C9 H15 N2 O9 P | C1CN(C(=O).... |
9 | 4KPX | ic50 = 0.05 uM | 1SE | C19 H14 N4 O5 | c1ccnc(c1).... |
10 | 4KNR | ic50 = 1.8 uM | 1S8 | C29 H24 N4 O3 | COc1cc2c(c.... |
11 | 2VD4 | ic50 = 18 uM | P21 | C24 H31 Cl N2 O2 | COCCCN([C@.... |
12 | 4KQL | ic50 = 0.0017 uM | 1SG | C24 H19 N5 O5 | COc1cc(cc(.... |
13 | 1HV9 | - | COA | C21 H36 N7 O16 P3 S | CC(C)(CO[P.... |
14 | 2OI6 | - | COA | C21 H36 N7 O16 P3 S | CC(C)(CO[P.... |
15 | 2OI5 | - | UD1 | C17 H27 N3 O17 P2 | CC(=O)N[C@.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1 families. | |||||
1 | 4AA7 | ic50 = 2 uM | R82 | C19 H22 N2 O5 S | C[C@@H]1Cc.... |
2 | 3TWD | ic50 = 0.018 uM | GOB | C24 H25 N3 O7 S | COc1cc(c(c.... |
3 | 1FWY | - | UD1 | C17 H27 N3 O17 P2 | CC(=O)N[C@.... |
4 | 2V0K | - | UDP | C9 H14 N2 O12 P2 | C1=CN(C(=O.... |
5 | 4E1K | Kd = 0.5 uM | 0N5 | C22 H18 N4 O3 | COc1cc2c(c.... |
6 | 4KNX | ic50 = 3.2 uM | 1S9 | C24 H20 N4 O5 | COc1cc2c(c.... |
7 | 4KPZ | - | 1SF | C10 H9 N3 O4 | c1cc(cc(c1.... |
8 | 2V0I | - | UD1 | C17 H27 N3 O17 P2 | CC(=O)N[C@.... |
9 | 2V0L | - | URI | C9 H12 N2 O6 | C1=CN(C(=O.... |
10 | 2V0J | - | H2U | C9 H15 N2 O9 P | C1CN(C(=O).... |
11 | 4KPX | ic50 = 0.05 uM | 1SE | C19 H14 N4 O5 | c1ccnc(c1).... |
12 | 4KNR | ic50 = 1.8 uM | 1S8 | C29 H24 N4 O3 | COc1cc2c(c.... |
13 | 2VD4 | ic50 = 18 uM | P21 | C24 H31 Cl N2 O2 | COCCCN([C@.... |
14 | 4KQL | ic50 = 0.0017 uM | 1SG | C24 H19 N5 O5 | COc1cc(cc(.... |
15 | 1HV9 | - | COA | C21 H36 N7 O16 P3 S | CC(C)(CO[P.... |
16 | 2OI6 | - | COA | C21 H36 N7 O16 P3 S | CC(C)(CO[P.... |
17 | 2OI5 | - | UD1 | C17 H27 N3 O17 P2 | CC(=O)N[C@.... |
18 | 1HM9 | - | UD1 | C17 H27 N3 O17 P2 | CC(=O)N[C@.... |
19 | 1HM8 | - | ACO | C23 H38 N7 O17 P3 S | CC(=O)SCCN.... |
20 | 4AAW | ic50 = 0.5 uM | R84 | C29 H37 N3 O11 S | COc1cc(c(c.... |
21 | 1G97 | - | UD1 | C17 H27 N3 O17 P2 | CC(=O)N[C@.... |
22 | 4AC3 | ic50 = 110 uM | R83 | C22 H29 N3 O5 S | CC(=O)Nc1c.... |
23 | 3DJ4 | - | UD1 | C17 H27 N3 O17 P2 | CC(=O)N[C@.... |
24 | 4G87 | - | UD1 | C17 H27 N3 O17 P2 | CC(=O)N[C@.... |
25 | 6GE9 | Kd = 250 uM | ACO | C23 H38 N7 O17 P3 S | CC(=O)SCCN.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | 1SG | 1 | 1 |
No: | Ligand | Similarity coefficient |
---|
This union binding pocket(no: 2) in the query (biounit: 4kql.bio1) has 40 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 3) in the query (biounit: 4kql.bio1) has 40 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |