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MolNFT v1 · #187268 · protein

Crystal structure of the G391V variant of human pgm-1

7S77 · Phosphoglucomutase-1: “Crystal structure of the G391V variant of human pgm-1”. X-ray diffraction, 1 ligand (SO4), 11 pockets (best druggability 0.69). MolNFT v1 #187268 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7S77
Type
protein
Length
1,077 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Phosphoglucomutase-1
EC
5.4.2.2
UniProt
P36871
Ligands
SO4
Pockets
11 · best druggability 0.69

Structure

x-ray diffraction · 2 distinct chains · 37% helix, 25% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APhosphoglucomutase-1 (EC 5.4.2.2)protein54838% helix, 26% strandP36871
BPhosphoglucomutase-1 (EC 5.4.2.2)protein52936% helix, 24% strandP36871

Ligands and binding sites

  • SO4 · Sulfate ion · ion · chains A

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

Pockets

11 pockets found on a 1 Å grid, 7 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15020.690.8074empty
22720.690.8443empty
34970.680.7965SO4
44730.630.7657empty
51680.580.8238empty

Interfaces

1 interface between chains.

  • A–B · 582 Ų buried · 10 hydrogen bonds · protein-protein

Compared structures

  • 7S77 · Crystal structure of the G391V variant of human PGM-1 · the same entry in another collection · chain A against A, TM-score 1.00
  • P36871 · AlphaFold monomer V2.0 prediction for phosphoglucomutase-1 (P36871) · a predicted model of the same protein · chain B against A, TM-score 0.98

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