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MolNFT v1 · #182017 · protein

The internal aldimine form of the wild-type salmonella typhimurium tryptophan synthase in complex with N-(4'-trifluoromethoxybenzoyl)-2- amino-1-ethylphosphate (F6F) inhibitor at the beta-site, sodium ion at the metal coordination site and dual beta-Q114 rotamer conformation at 1.60 ångström resolution

7ME8: “The internal aldimine form of the wild-type salmonella typhimurium tryptophan synthase in complex with…”. X-ray diffraction, 3 ligands (PLP, F6F, NA). MolNFT v1 #182017 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7ME8
Type
protein
Length
645 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
P00929, P0A2K1
Ligands
PLP, F6F, NA

Structure

x-ray diffraction · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein252—P00929
B—protein393—P0A2K1

Ligands and binding sites

  • PLP · Pyridoxal-5'-phosphate · ligand · chains B
  • F6F · 2-{[4-(trifluoromethoxy)benzoyl]amino}ethyl dihydrogen phosphate · ligand · chains B
  • NA · Sodium ion · metal · chains B
  • EDO · 1,2-ethanediol · additive · chains A
  • PEG · Di(hydroxyethyl)ether · additive · chains B

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

Compared structures

  • 7ME8 · The internal aldimine form of the wild-type Salmonella Typhimurium Tryptophan Synthase in… · the same entry in another collection · chain A against A, TM-score 1.00

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