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MolNFT v1 · #126774 · protein

The structure of the mature HIV-1 ca pentamer in intact virus particles

5MCY · Capsid protein P24: “The structure of the mature HIV-1 ca pentamer in intact virus particles”. Electron microscopy, 20 pockets (best druggability 0.42). MolNFT v1 #126774 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5MCY
Type
protein
Length
4,420 residues
Chains
20
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Capsid protein P24
UniProt
B6DRA0
Pockets
20 · best druggability 0.42

Structure

electron microscopy · 1 distinct chain · 60% helix, 3% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, F, R, S, T, P, Q, M, N, O, G, d, g, b, e, h, Z, c, fCapsid protein P24protein22160% helix, 3% strandB6DRA0

Pockets

20 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12000.420.7337empty
21950.410.7337empty
31860.400.7232empty
41650.390.7331empty
51590.370.7233empty

Interfaces

21 interfaces between chains.

  • b–e · 134 Ų buried · 0 hydrogen bonds · protein-protein
  • d–g · 130 Ų buried · 0 hydrogen bonds · protein-protein
  • Z–c · 129 Ų buried · 0 hydrogen bonds · protein-protein
  • R–S · 126 Ų buried · 0 hydrogen bonds · protein-protein
  • A–F · 125 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 5MCY · The structure of the mature HIV-1 CA pentamer in intact virus particles · the same entry in another collection · chain A against A, TM-score 1.00

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