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MolNFT v1 · #121623 · protein

Copper-bound M90I variant of uropathogenic escherichia COLI strain F11 fetp

5I0X · Periplasmic protein-probably involved in high-affinity FE2+…: “Copper-bound M90I variant of uropathogenic escherichia COLI strain F11 fetp”. X-ray diffraction, 1 ligand (CU), 2 pockets (best druggability 0.53). MolNFT v1 #121623 on…

PDB
5I0X
Type
protein
Length
311 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Periplasmic protein-probably involved in high-affinity FE2+ transport
UniProt
A0A0J9WZP9
Ligands
CU
Pockets
2 · best druggability 0.53

Structure

x-ray diffraction · 2 distinct chains · 5% helix, 49% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APeriplasmic protein-probably involved in high-affinity FE2+ transportprotein1535% helix, 51% strandA0A0J9WZP9
BPeriplasmic protein-probably involved in high-affinity FE2+ transportprotein1584% helix, 46% strandA0A0J9WZP9

Ligands and binding sites

  • CU · Copper (II) ion · metal · 3 copies · chains A, B

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

Pockets

2 pockets found on a 1 Å grid, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11710.530.7932empty
2690.290.7324empty

Interfaces

1 interface between chains.

  • A–B · 1739 Ų buried · 23 hydrogen bonds · protein-protein

Compared structures

  • 5I0X · Copper-bound M90I variant of uropathogenic escherichia COLI strain F11 fetp · the same entry in another collection · chain A against A, TM-score 1.00

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