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MolNFT v1 · #30689 · protein

Structure solution to 2.2 ångström and functional characterisation of the open reading frame RV3214 from mycobacterium tuberculosis

2A6P · Possible phosphoglycerate mutase GPM2: “Structure solution to 2.2 ångström and functional characterisation of the open reading frame RV3214 from…”. X-ray diffraction, 1 ligand (SO4), 1 pocket (best druggability 0.73). MolNFT v1…

PDB
2A6P
Type
protein
Length
386 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Possible phosphoglycerate mutase GPM2
EC
5.4.2.1
UniProt
Q6MWZ7
Ligands
SO4
Pockets
1 · best druggability 0.73

Structure

x-ray diffraction · 1 distinct chain · 40% helix, 20% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BPossible phosphoglycerate mutase GPM2 (EC 5.4.2.1)protein19340% helix, 20% strandQ6MWZ7

Ligands and binding sites

  • SO4 · Sulfate ion · ion · 2 copies · chains A, B
  • GOL · Glycerol · additive · 2 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16920.730.7994SO4, GOL

Interfaces

1 interface between chains.

  • A–B · 1026 Ų buried · 26 hydrogen bonds · protein-protein

Compared structures

  • 2A6P · Structure Solution to 2.2 Angstrom and Functional Characterisation of the Open Reading… · the same entry in another collection · chain A against A, TM-score 1.00
  • Q6MWZ7 · AlphaFold monomer V2.0 prediction for acid phosphatase (Q6MWZ7) · a predicted model of the same protein · chain A against A, TM-score 1.00

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