MolNFT v1 · #468815 · protein
AlphaFold monomer V2.0 prediction for toluene-4-monooxygenase system, hydroxylase component subunit alpha (Q00456)
Q00456: “AlphaFold monomer V2.0 prediction for toluene-4-monooxygenase system, hydroxylase component subunit alpha…”. 7 pockets (best druggability 0.57). MolNFT v1 #468815 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- Accession
- Q00456
- Type
- protein
- Length
- 500 residues
- Chains
- 1
- Collection
- MolNFT v1 / AlphaFold
- Contract
- 0xBf7491af3407816DFa88a5EA4c82e8A2B1D721eD
- Owner
- 0x8BD7f91495A0EDa7B1D4f7CeF7b51C4d1bb1aA84
- Molecule
- Toluene-4-monooxygenase system, hydroxylase component subunit alpha
- UniProt
- Q00456
- Pockets
- 7 · best druggability 0.57
Structure
1 distinct chain · 68% helix, 3% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Toluene-4-monooxygenase system, hydroxylase component subunit alpha | protein | 500 | 68% helix, 3% strand | Q00456 |
Pockets
7 pockets found on a 1 Å grid, 1 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 131 | 0.57 | 0.83 | 19 | empty |
| 2 | 127 | 0.41 | 0.75 | 20 | empty |
| 3 | 84 | 0.40 | 0.78 | 19 | empty |
| 4 | 76 | 0.35 | 0.76 | 16 | empty |
| 5 | 95 | 0.34 | 0.74 | 20 | empty |
Compared structures
- 3RI7 · Toluene 4 monooxygenase hd mutant G103L · an experimental structure of the same protein · chain A against A, TM-score 0.98
- 3RI7 · Toluene 4 monooxygenase HD Mutant G103L · an experimental structure of the same protein · chain A against A, TM-score 0.98
- 3RMK · Toluene 4 monooxygenase H with 4-bromophenol · an experimental structure of the same protein · chain A against A, TM-score 0.98
- 3RMK · Toluene 4 monooxygenase H with 4-bromophenol · an experimental structure of the same protein · chain A against A, TM-score 0.98
- 5TDV · Intermediate O2 diiron complex in the Q228A variant of toluene 4- moonoxygenase (T4MOHD) · an experimental structure of the same protein · chain A against A, TM-score 0.98
- 5TDU · Toluene 4-monooxygenase (T4MOHD) bound to product after turnover in crystal · an experimental structure of the same protein · chain A against A, TM-score 0.98
- 5TDU · Toluene 4-monooxygenase (T4moHD) bound to product after turnover in crystal · an experimental structure of the same protein · chain A against A, TM-score 0.98
- 5TDT · Oxygenated toluene intermediate in toluene 4-monooxygenase (T4MOHD) after reaction in the… · an experimental structure of the same protein · chain A against D, TM-score 0.98
- 5TDS · Toluene bound in the resting active site of toluene 4-monooxygenase (T4MOH) · an experimental structure of the same protein · chain A against A, TM-score 0.98
- 4P1B · Crystal structure of the toluene 4-monooxygenase hydroxylase- ferredoxin C7S E16C C84A… · an experimental structure of the same protein · chain A against A, TM-score 0.97
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 Q00456
- Elsewhere: UniProt Q00456 · AlphaFold DB Q00456
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