GL1X · GenesisL1 explorer

MolNFT v1 · #46524 · protein

Tyrosine ammonia-lyase from rhodobacter sphaeroides

2O6Y · Putative histidine ammonia-lyase: “Tyrosine ammonia-lyase from rhodobacter sphaeroides”. X-ray diffraction, 20 pockets (best druggability 0.81). MolNFT v1 #46524 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
2O6Y
Type
protein
Length
4,114 residues
Chains
8
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Putative histidine ammonia-lyase
EC
4.3.1.-
UniProt
Q3IWB0
Pockets
20 · best druggability 0.81

Structure

x-ray diffraction · 2 distinct chains · 56% helix, 7% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BPutative histidine ammonia-lyase (EC 4.3.1.-)protein51556% helix, 7% strandQ3IWB0
C, D, E, F, G, HPutative histidine ammonia-lyase (EC 4.3.1.-)protein51456% helix, 7% strandQ3IWB0

Pockets

20 pockets found on a 1 Å grid, 20 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11350.810.9838empty
22880.800.9253empty
31220.800.9831empty
41480.800.9733empty
51260.800.9733empty

Interfaces

18 interfaces between chains.

  • A–D · 4667 Ų buried · 69 hydrogen bonds · protein-protein
  • F–G · 4664 Ų buried · 70 hydrogen bonds · protein-protein
  • E–H · 4663 Ų buried · 71 hydrogen bonds · protein-protein
  • B–C · 4654 Ų buried · 68 hydrogen bonds · protein-protein
  • A–B · 3165 Ų buried · 50 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 8 modified (nonstandard).

Compared structures

  • 2O6Y · Tyrosine ammonia-lyase from Rhodobacter sphaeroides · the same entry in another collection · chain B against B, TM-score 1.00
  • Q3IWB0 · AlphaFold monomer V2.0 prediction for tyrosine ammonia-lyase (Q3IWB0) · a predicted model of the same protein · chain C against A, TM-score 1.00

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