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X-ray structure of nika from escherichia COLI in complex with fe-6- ME2-bpmcn

Analyse X-ray structure of nika from escherichia COLI in complex with fe-6- ME2-bpmcn in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7A0C
Type
protein
Length
996 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
P33590
Ligands
QTT, MG, FE, CL

Structure

x-ray diffraction · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein498—P33590
B—protein498—P33590

Ligands and binding sites

  • QTT · 2-[[(1~{S},2~{S})-2-[methyl-[(6-methylpyridin-2-yl) methyl]amino]cyclohexyl]-[(6-methylpyridin-2-yl) methyl]amino]ethanoic acid · ligand · 2 copies · chains A, B
  • MG · Magnesium ion · metal · 5 copies · chains A, B
  • FE · Fe (III) ion · metal · 2 copies
  • CL · Chloride ion · ion · chains B
  • ACT · Acetate ion · additive · 9 copies · chains A, B
  • GOL · Glycerol · additive · 9 copies · chains A, B

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

Compared structures

  • 7A0C · X-ray structure of NikA from Escherichia coli in complex with Fe-6-Me2-BPMCN · the same entry in another collection · chain A against A, TM-score 1.00

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