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Crystal structure of hexameric HBC149 Y132A

Analyse Crystal structure of hexameric HBC149 Y132A in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4BMG
Type
protein
Length
855 residues
Chains
6
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Capsid protein
UniProt
P03147
Pockets
9 · best druggability 0.69

Structure

x-ray diffraction · 2 distinct chains · 59% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, C, ECapsid proteinprotein14361% helix, 0% strandP03147
B, D, FCapsid proteinprotein14258% helix, 0% strandP03147

Pockets

9 pockets found on a 1 Å grid, 5 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12420.690.8527empty
22120.660.8435empty
3710.610.9021empty
41220.600.8525empty
5750.500.8314empty

Interfaces

7 interfaces between chains.

  • C–D · 2065 Ų buried · 18 hydrogen bonds · protein-protein
  • E–F · 1967 Ų buried · 20 hydrogen bonds · protein-protein
  • A–B · 1941 Ų buried · 22 hydrogen bonds · protein-protein
  • A–F · 582 Ų buried · 2 hydrogen bonds · protein-protein
  • C–E · 521 Ų buried · 2 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 3 disulfide (disulfide).

Compared structures

  • 4BMG · Crystal structure of hexameric HBc149 Y132A · the same entry in another collection · chain A against A, TM-score 1.00

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