MolNFT v1 · #94402 · protein
X-ray crystal structure of salicylic acid bound 3-hydroxyanthranilate- 3,4-dioxygenase from cupriavidus metallidurans
4HVR · 3-hydroxyanthranilate 3,4-dioxygenase: “X-ray crystal structure of salicylic acid bound 3-hydroxyanthranilate- 3,4-dioxygenase from cupriavidus…”. X-ray diffraction, 2 ligands (SAL, FE), 2 pockets (best druggability 0.73). MolNFT v1…
- PDB
- 4HVR
- Type
- protein
- Length
- 174 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- 3-hydroxyanthranilate 3,4-dioxygenase
- EC
- 1.13.11.6
- UniProt
- Q1LCS4
- Ligands
- SAL, FE
- Pockets
- 2 · best druggability 0.73
Structure
x-ray diffraction · 1 distinct chain · 11% helix, 37% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | 3-hydroxyanthranilate 3,4-dioxygenase (EC 1.13.11.6) | protein | 174 | 11% helix, 37% strand | Q1LCS4 |
Ligands and binding sites
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
2 pockets found on a 1 Å grid, 1 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 378 | 0.73 | 0.84 | 39 | SAL |
| 2 | 103 | 0.37 | 0.75 | 17 | empty |
Compared structures
- 4HVR · X-ray crystal structure of salicylic acid bound 3-hydroxyanthranilate-3,4-dioxygenase… · the same entry in another collection · chain A against A, TM-score 1.00
- Q1LCS4 · AlphaFold monomer V2.0 prediction for 3-hydroxyanthranilate 3,4-dioxygenase (Q1LCS4) · a predicted model of the same protein · chain A against A, TM-score 0.99
Analyse
- Open in the research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides and crosslinks on the 3D structure
- Every structure of UniProt Q1LCS4
- Elsewhere: RCSB PDB 4HVR · PDBe 4HVR · UniProt Q1LCS4
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