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MolNFT v1 · #150367 · protein

E. COLI microcin synthetase mcbbcd complex with pro-MCCB17, ADP and phosphate bound

6GRG: “E. COLI microcin synthetase mcbbcd complex with pro-MCCB17, ADP and phosphate bound”. X-ray diffraction, 9 ligands (F6N, FMN, ATP). MolNFT v1 #150367 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6GRG
Type
protein
Length
1,247 residues
Chains
5
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
P05834, P23184, P23185, P23186
Ligands
F6N, FMN, ATP, ADP, MG, ZN, SO4, PO4, CL

Structure

x-ray diffraction · 5 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein20—P05834
1—protein284—P23184
2—protein282—P23184
C—protein265—P23185
D—protein396—P23186

Ligands and binding sites

  • F6N · 2-(aminomethyl)-1,3-oxazole-4-carboxylic acid · ligand · chains A, C
  • FMN · Flavin mononucleotide · ligand · chains A, C
  • ATP · Adenosine-5'-triphosphate · ligand · chains 2
  • ADP · Adenosine-5'-diphosphate · ligand · chains D
  • MG · Magnesium ion · metal · 3 copies · chains D
  • ZN · Zinc ion · metal · 2 copies · chains 1, 2
  • SO4 · Sulfate ion · ion · chains 1
  • PO4 · Phosphate ion · ion · chains D
  • CL · Chloride ion · ion · chains D
  • EDO · 1,2-ethanediol · additive · 2 copies · chains 2, D
  • GOL · Glycerol · additive · chains 1

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

Compared structures

  • 6GRG · E. coli Microcin synthetase McbBCD complex with pro-MccB17, ADP and phosphate bound · the same entry in another collection · chain D against D, TM-score 1.00
  • P23186 · AlphaFold monomer V2.0 prediction for microcin B17-processing protein mcbd (P23186) · a predicted model of the same protein · chain D against A, TM-score 1.00
  • P23185 · AlphaFold monomer V2.0 prediction for microcin B17-processing protein mcbc (P23185) · a predicted model of the same protein · chain C against A, TM-score 0.94
  • P23184 · AlphaFold monomer V2.0 prediction for microcin B17-processing protein mcbb (P23184) · a predicted model of the same protein · chain 1 against A, TM-score 0.89
  • P05834 · AlphaFold monomer V2.0 prediction for bacteriocin microcin B17 (P05834) · a predicted model of the same protein · chain A against A, TM-score 0.59

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