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Crystal structure of human R180T variant of ornithine aminotransferase at 1.8 ångström

Analyse Crystal structure of human R180T variant of ornithine aminotransferase at 1.8… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6HX7
Type
protein
Length
1,187 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Ornithine aminotransferase, mitochondrial
EC
2.6.1.13
UniProt
P04181
Ligands
PLP
Pockets
15 · best druggability 0.64

Structure

x-ray diffraction · 2 distinct chains · 39% helix, 18% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, COrnithine aminotransferase, mitochondrial (EC 2.6.1.13)protein39439% helix, 17% strandP04181
BOrnithine aminotransferase, mitochondrial (EC 2.6.1.13)protein39939% helix, 18% strandP04181

Ligands and binding sites

  • PLP · Pyridoxal-5'-phosphate · ligand · 3 copies · chains A, B, C

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

15 pockets found on a 1 Å grid, 5 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15450.640.7668PLP
24810.630.7662PLP
33230.580.7732empty
42850.570.7732empty
52960.540.7547PLP

Interfaces

2 interfaces between chains.

  • B–C · 267 Ų buried · 4 hydrogen bonds · protein-protein
  • A–B · 263 Ų buried · 1 hydrogen bond · protein-protein

Compared structures

  • 6HX7 · Crystal structure of human R180T variant of ORNITHINE AMINOTRANSFERASE at 1.8 Angstrom · the same entry in another collection · chain A against A, TM-score 1.00
  • P04181 · AlphaFold monomer V2.0 prediction for ornithine aminotransferase, mitochondrial (P04181) · a predicted model of the same protein · chain A against A, TM-score 1.00

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