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MolNFT v1 · #102936 · protein

Native structure of the P domain from a GI.7 norovirus variant.

4P12 · Major capsid protein: “Native structure of the P domain from a GI.7 norovirus variant.”. X-ray diffraction, 9 pockets (best druggability 0.79). MolNFT v1 #102936 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
4P12
Type
protein
Length
1,169 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Major capsid protein
UniProt
G8FL04
Pockets
9 · best druggability 0.79

Structure

x-ray diffraction · 4 distinct chains · 7% helix, 33% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMajor capsid proteinprotein2966% helix, 33% strandG8FL04
BMajor capsid proteinprotein2889% helix, 33% strandG8FL04
CMajor capsid proteinprotein2957% helix, 32% strandG8FL04
DMajor capsid proteinprotein2907% helix, 34% strandG8FL04

Pockets

9 pockets found on a 1 Å grid, 6 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15640.790.8574empty
25440.790.8673empty
31020.570.8529empty
42650.560.7738empty
51240.540.8234empty

Interfaces

3 interfaces between chains.

  • B–C · 1626 Ų buried · 9 hydrogen bonds · protein-protein
  • A–D · 1547 Ų buried · 11 hydrogen bonds · protein-protein
  • A–C · 450 Ų buried · 4 hydrogen bonds · protein-protein

Compared structures

  • 4P12 · Native Structure of the P domain from a GI.7 Norovirus variant. · the same entry in another collection · chain A against A, TM-score 1.00

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