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Receptor
PDB id Resolution Class Description Source Keywords
4LBP 1.87 Å EC: 7.-.-.- 5-CHLORO-2-HYDROXYHYDROQUINONE DEHYDROCHLORINASE (TFTG) FROM BURKHOLDERIA PHENOLIRUPTRIX AC1100: COMPLEX WITH 2,5- D IHYDROXYBENZOQUINONE BURKHOLDERIA CEPACIA LYASE
Ref.: CATALYTIC MECHANISM OF 5-CHLOROHYDROXYHYDROQUINONE DEHYDROCHLORINASE FROM THE YCII SUPERFAMILY OF LARG UNKNOWN FUNCTION. J.BIOL.CHEM. V. 288 28447 2013
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
1WG A:201;
Valid;
none;
Kd = 11.4 uM
140.094 C6 H4 O4 C1=C(...
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90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
4LBP 1.87 Å EC: 7.-.-.- 5-CHLORO-2-HYDROXYHYDROQUINONE DEHYDROCHLORINASE (TFTG) FROM BURKHOLDERIA PHENOLIRUPTRIX AC1100: COMPLEX WITH 2,5- D IHYDROXYBENZOQUINONE BURKHOLDERIA CEPACIA LYASE
Ref.: CATALYTIC MECHANISM OF 5-CHLOROHYDROXYHYDROQUINONE DEHYDROCHLORINASE FROM THE YCII SUPERFAMILY OF LARG UNKNOWN FUNCTION. J.BIOL.CHEM. V. 288 28447 2013
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 293 families.
1 4LBP Kd = 11.4 uM 1WG C6 H4 O4 C1=C(C(=O)....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 250 families.
1 4LBP Kd = 11.4 uM 1WG C6 H4 O4 C1=C(C(=O)....
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 204 families.
1 4LBP Kd = 11.4 uM 1WG C6 H4 O4 C1=C(C(=O)....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: 1WG; Similar ligands found: 1
No: Ligand ECFP6 Tc MDL keys Tc
1 1WG 1 1
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 4LBP; Ligand: 1WG; Similar sites found with APoc: 63
This union binding pocket(no: 1) in the query (biounit: 4lbp.bio1) has 15 residues
No: Leader PDB Ligand Sequence Similarity
1 1UO5 PIH None
2 1UVC STE None
3 5JF2 SF7 None
4 3RV5 DXC None
5 3AQT RCO None
6 1MID LAP None
7 3GZ8 APR None
8 5G3N X28 None
9 4WG0 CHD None
10 3GUZ PAF None
11 3GYT DL4 2
12 1XZ3 ICF 3
13 4R38 RBF 3
14 4FGC PQ0 3
15 4BNU 9KQ 3
16 4YRD 3IT 4
17 4BQS K2Q 4
18 4BQS ADP 4
19 2J7T 274 4
20 2FXU ATP 4
21 3KMZ EQO 5
22 3COW 52H 5
23 5MW4 5JU 5
24 2DC1 CIT 5
25 5ACM MBT 5
26 1SBR VIB 5
27 4O08 PO6 6
28 3ZUY TCH 6
29 4MGA 27L 6
30 4DK7 0KS 6
31 4XFR CIT 6
32 3KP6 SAL 6
33 4EMV 0R9 6
34 3O01 DXC 7
35 6CB2 OLC 7
36 4EOX 0S5 7
37 3HP9 CF1 7
38 4JX1 CAH 7
39 3LOO B4P 7
40 5C1M OLC 8
41 6IIU A8X 8
42 2UXI G50 8
43 1HG4 LPP 8.60215
44 5XNA SHV 9
45 4H03 ATP 9
46 4H03 LAR 9
47 4O4Z N2O 10
48 2YFB SIN 10
49 2OKL BB2 10
50 4RKK GLC GLC GLC GLC GLC GLC 10
51 1Y75 NAG 10
52 2F5T MAL 11
53 3P7N FMN 12
54 5LX9 OLB 12
55 2BHW NEX 14
56 4CBX ATP 16
57 1DMH LIO 17
58 1DTL BEP 20
59 5TQZ GLC 20
60 5ALC TIQ 22
61 4RYV ZEA 23
62 2P1C GG3 23
63 2R75 01G 28
Pocket No.: 2; Query (leader) PDB : 4LBP; Ligand: 1WG; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 2) in the query (biounit: 4lbp.bio1) has 15 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 4LBP; Ligand: 1WG; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 3) in the query (biounit: 4lbp.bio1) has 15 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 4; Query (leader) PDB : 4LBP; Ligand: 1WG; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 4) in the query (biounit: 4lbp.bio1) has 15 residues
No: Leader PDB Ligand Sequence Similarity
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