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MolNFT v1 · #115227 · protein

Crystal structure of israel acute paralysis virus

5CDC · VP1, structural polyprotein: “Crystal structure of israel acute paralysis virus”. X-ray diffraction, 8 pockets (best druggability 0.77). MolNFT v1 #115227 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5CDC
Type
protein
Length
791 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
VP1, structural polyprotein; VP2, structural polyprotein; VP3, structural polyprotein; VP4
UniProt
D1FK67
Pockets
8 · best druggability 0.77

Structure

x-ray diffraction · 4 distinct chains · 10% helix, 26% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AVP1, structural polyproteinprotein20318% helix, 32% strandD1FK67
BVP2, structural polyproteinprotein3005% helix, 31% strandD1FK67
CVP3, structural polyproteinprotein24311% helix, 21% strandD1FK67
DVP4protein450% helix, 0% strand—

Pockets

8 pockets found on a 1 Å grid, 4 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1880.770.9826empty
26730.660.7674empty
31360.550.8227empty
42590.530.7636empty
5850.430.7919empty

Interfaces

5 interfaces between chains.

  • A–B · 4586 Ų buried · 64 hydrogen bonds · protein-protein
  • B–C · 1586 Ų buried · 20 hydrogen bonds · protein-protein
  • A–C · 1094 Ų buried · 12 hydrogen bonds · protein-protein
  • B–D · 563 Ų buried · 4 hydrogen bonds · protein-protein
  • A–D · 83 Ų buried · 0 hydrogen bonds · protein-protein

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