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MolNFT v1 · #26902 · protein

Crystal structure of the PH0495 protein from pyrococccus horikoshii OT3

1X3L · Hypothetical protein PH0495: “Crystal structure of the PH0495 protein from pyrococccus horikoshii OT3”. X-ray diffraction, 1 ligand (SO4), 2 pockets (best druggability 0.50). MolNFT v1 #26902 on GenesisL1: 3D structure, binding…

PDB
1X3L
Type
protein
Length
436 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Hypothetical protein PH0495
EC
2.7.1.31
UniProt
O58231
Ligands
SO4
Pockets
2 · best druggability 0.50

Structure

x-ray diffraction · 1 distinct chain · 38% helix, 21% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AHypothetical protein PH0495 (EC 2.7.1.31)protein43638% helix, 21% strandO58231

Ligands and binding sites

  • SO4 · Sulfate ion · ion · chains A
  • EDO · 1,2-ethanediol · additive · 4 copies · chains A

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.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12110.500.7628SO4
2900.420.7918empty

Compared structures

  • 1X3L · Crystal structure of the PH0495 protein from pyrococccus horikoshii OT3 · the same entry in another collection · chain A against A, TM-score 1.00
  • O58231 · AlphaFold monomer V2.0 prediction for glycerate 2-kinase (O58231) · a predicted model of the same protein · chain A against A, TM-score 0.97

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