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Bacterial initiation protein in complex with phage inhibitor protein

Analyse Bacterial initiation protein in complex with phage inhibitor protein in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5HE9
Type
protein
Length
224 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Helicase loader; Phage inhibitor protein
UniProt
W8TSU2, A0A0J7LG86
Ligands
ADP, BEF, MG
Pockets
1 · best druggability 0.37

Structure

x-ray diffraction · 2 distinct chains · 60% helix, 12% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AHelicase loaderprotein16856% helix, 14% strandW8TSU2
EPhage inhibitor proteinprotein5671% helix, 5% strandA0A0J7LG86

Ligands and binding sites

  • ADP · Adenosine-5'-diphosphate · ligand · chains A
  • BEF · Beryllium trifluoride ion · ligand · chains A, E
  • MG · Magnesium ion · metal · chains A, E

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
1640.370.7917BEF, MG

Interfaces

1 interface between chains.

  • A–E · 1240 Ų buried · 13 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 4 modified (engineered).

Compared structures

  • 5HE9 · Bacterial initiation protein in complex with Phage inhibitor protein · the same entry in another collection · chain A against A, TM-score 1.00

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