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Ligand clusters for UniProt code P95607

Ligand clusters for P95607: Catechol 1,2-dioxygenase (Fragment) from Rhodococcus opacus

4 ligand clusters


Cluster 1. 12 ligand types 21 ligands		Cluster 2. 1 ligand type 10 ligands		Cluster 3. 1 ligand type 1 ligand		Cluster 4. 1 ligand type 1 ligand

Representative protein: 3hgiA

Structures

PDB		Schematic diagram

3hgiA
3hhxA
3hjqA
3hjsA
3hhyA
		more ...

Cluster 1 contains 12 ligand types

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Ligand

Description

_Fe

1. Metal: _FE × 10

PDB codes: 3hgi(A), 3hhx(A), 3hhy(A), 3hj8(A), 3hjq(A), 3hjs(A), 3hkp(A), 3i4v(A), 3i4y(A), 3i51(A).

2. Ligand: BEZ × 1

benzoic acid

Benzoic acid

PDB code: 3hgi(A).

3. Ligand: 35C × 1

3,5-Dichlorobenzene-1,2-Diol

PDB code: 3i4y(A).

4. Ligand: 3CE × 1

3-Chlorobenzene-1,2-Diol

PDB code: 3i4v(A).

5. Ligand: 45C × 1

4,5-Dichlorobenzene-1,2-Diol

PDB code: 3i51(A).

6. Ligand: 4CL × 1

4-Chlorobenzene-1,2-Diol

PDB code: 3hj8(A).

7. Ligand: CAQ × 1

Catechol

PDB code: 3hhy(A).

8. Ligand: CO3 × 1

Carbonate ion

PDB code: 3hgi(A).

9. Ligand: DHB × 1

3,4-Dihydroxybenzoic acid

PDB code: 3hkp(A).

10. Ligand: MBD × 1

3-Methylcatechol

PDB code: 3hjq(A).

11. Ligand: MCT × 1

4-Methylcatechol

PDB code: 3hjs(A).

12. Ligand: PYG × 1

Benzene-1,2,3-Triol

PDB code: 3hhx(A).

Cluster 2 contains 1 ligand type

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Ligand

Description

1. Ligand: 6PL × 10

(4s,7r)-4-Hydroxy-N,N,N-Trimethyl-9-Oxo-7- [(Palmitoyloxy)methyl]-3,5,8-Trioxa-4-
Phosphahexacosan-1-Aminium 4-Oxide