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MolNFT v1 · #16550 · protein

Complex of enzyme iiaglc and iibglc phosphocarrier protein hpr from escherichia COLI NMR, restrained regularized mean structure

1O2F · Pts system, glucose-specific iia component: “Complex of enzyme iiaglc and iibglc phosphocarrier protein hpr from escherichia COLI NMR, restrained…”. Solution nmr, 1 ligand (PO3), 1 pocket (best druggability 0.36). MolNFT v1 #16550…

PDB
1O2F
Type
protein
Length
227 residues
Chains
2
Method
solution nmr
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Pts system, glucose-specific iia component; Pts system, glucose-specific iibc component
EC
2.7.1.69
UniProt
P69783, P69786
Ligands
PO3
Pockets
1 · best druggability 0.36

Structure

solution nmr · 2 distinct chains · 24% helix, 37% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APts system, glucose-specific iia component (EC 2.7.1.69)protein15014% helix, 41% strandP69783
BPts system, glucose-specific iibc component (EC 2.7.1.69)protein7744% helix, 27% strandP69786

Ligands and binding sites

  • PO3 · Phosphite ion · ion · chains A, B

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
1660.360.7814empty

Interfaces

1 interface between chains.

  • A–B · 608 Ų buried · 6 hydrogen bonds · protein-protein

Compared structures

  • 1O2F · Complex of enzyme iiaglc and iibglc phosphocarrier protein hpr from escherichia COLI NMR… · the same entry in another collection · chain B against B, TM-score 1.00
  • P69783 · AlphaFold monomer V2.0 prediction for pts system glucose-specific eiia component (P69783) · a predicted model of the same protein · chain A against A, TM-score 0.99
  • P69786 · AlphaFold monomer V2.0 prediction for pts system glucose-specific eiicb component (P69786) · a predicted model of the same protein · chain B against A, TM-score 0.96

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