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MolNFT v1 · #34567 · protein

Crystal structure of N-acetylglucosamine-phosphate mutase, a member of the alpha-D-phosphohexomutase superfamily, in the apo-form

2DKA · Phosphoacetylglucosamine mutase: “Crystal structure of N-acetylglucosamine-phosphate mutase, a member of the alpha-D-phosphohexomutase…”. X-ray diffraction, 12 pockets (best druggability 0.73). MolNFT v1 #34567 on GenesisL1: 3D…

PDB
2DKA
Type
protein
Length
980 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Phosphoacetylglucosamine mutase
EC
5.4.2.3
UniProt
Q9P4V2
Pockets
12 · best druggability 0.73

Structure

x-ray diffraction · 2 distinct chains · 42% helix, 19% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APhosphoacetylglucosamine mutase (EC 5.4.2.3)protein51942% helix, 19% strandQ9P4V2
BPhosphoacetylglucosamine mutase (EC 5.4.2.3)protein46142% helix, 18% strandQ9P4V2

Pockets

12 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15200.730.8274empty
23090.710.8443empty
31740.510.7828empty
41990.500.7631empty
51150.480.8016empty

Interfaces

1 interface between chains.

  • A–B · 878 Ų buried · 17 hydrogen bonds · protein-protein

Compared structures

  • 2DKA · Crystal structure of N-acetylglucosamine-phosphate mutase, a member of the… · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9P4V2 · AlphaFold monomer V2.0 prediction for phosphoacetylglucosamine mutase (Q9P4V2) · a predicted model of the same protein · chain A against A, TM-score 0.99

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