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Bacteriophage G20C portal protein crystal structure for construct with intact N-terminus

Analyse Bacteriophage G20C portal protein crystal structure for construct with intact… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6IBG
Type
protein
Length
1,234 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Portal protein
UniProt
A7XXB9
Pockets
20 · best druggability 0.87

Structure

x-ray diffraction · 2 distinct chains · 46% helix, 17% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BPortal proteinprotein41246% helix, 17% strandA7XXB9
CPortal proteinprotein41047% helix, 17% strandA7XXB9

Ligands and binding sites

  • MPD · (4S)-2-methyl-2,4-pentanediol · additive · 3 copies · chains A, B, C

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

Pockets

20 pockets found on a 1 Å grid, 13 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17370.870.9188MPD
24240.860.9461empty
35230.840.9070empty
43060.810.9244empty
53760.710.8334empty

Interfaces

3 interfaces between chains.

  • A–B · 5594 Ų buried · 61 hydrogen bonds · protein-protein
  • B–C · 5573 Ų buried · 57 hydrogen bonds · protein-protein
  • A–C · 18 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 6IBG · Bacteriophage G20c portal protein crystal structure for construct with intact N-terminus · the same entry in another collection · chain A against A, TM-score 1.00

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