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MolNFT v1 · #157366 · protein

Crystal structure of 2C-methyl-D-erythritol 2,4-cyclodiphosphate synthase (ispf) burkholderia pseudomallei in complex with ligand hgn- 0883

6MWK: “Crystal structure of 2C-methyl-D-erythritol 2,4-cyclodiphosphate synthase (ispf) burkholderia pseudomallei in…”. X-ray diffraction, 3 ligands (K4Y, ZN, MG). MolNFT v1 #157366 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
6MWK
Type
protein
Length
480 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
Q3JRA0
Ligands
K4Y, ZN, MG

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C—protein160—Q3JRA0

Ligands and binding sites

  • K4Y · 4-amino-N-(6-methoxypyrimidin-4-yl)benzene-1-sulfonamide · ligand · 3 copies · chains A, B, C
  • ZN · Zinc ion · metal · 3 copies · chains A, B, C
  • MG · Magnesium ion · metal
  • DMS · Dimethyl sulfoxide · additive · 4 copies · chains A, B, C
  • MLA · Malonic acid · additive · chains A, B, C

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

Compared structures

  • 6MWK · Crystal structure of 2C-methyl-D-erythritol 2,4-cyclodiphosphate synthase (IspF)… · the same entry in another collection · chain A against A, TM-score 1.00
  • Q3JRA0 · AlphaFold monomer V2.0 prediction for 2-C-methyl-D-erythritol 2,4-cyclodiphosphate… · a predicted model of the same protein · chain A against A, TM-score 0.98

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