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Crystal structure of metal-citrate-binding mutant (Y221F) protein (mcta) of ABC transporter in apo state

Analyse Crystal structure of metal-citrate-binding mutant (Y221F) protein (mcta) of ABC… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7F6T
Type
protein
Length
337 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Iron ABC transporter, periplasmic iron-binding protein
UniProt
Q53VZ2
Ligands
NA, CL, CO2, PO4
Pockets
1 · best druggability 0.44

Structure

x-ray diffraction · 1 distinct chain · 48% helix, 18% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AIron ABC transporter, periplasmic iron-binding proteinprotein33748% helix, 18% strandQ53VZ2

Ligands and binding sites

  • NA · Sodium ion · metal · 2 copies · chains A
  • CL · Chloride ion · ion · chains A
  • CO2 · Carbon dioxide · ion · chains A
  • PO4 · Phosphate ion · ion · chains A
  • EDO · 1,2-ethanediol · additive · 3 copies · chains A
  • GOL · Glycerol · additive · chains A
  • ACT · Acetate ion · additive · chains A

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

Pockets

1 pocket found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11330.440.7627CL

Compared structures

  • 7F6T · Crystal structure of metal-citrate-binding mutant (Y221F) protein (MctA) of ABC… · the same entry in another collection · chain A against A, TM-score 1.00

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