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MolNFT v1 · #126781 · protein

The structure of the mature HIV-1 ca hexameric lattice with curvature parameters: TILT=11, TWIST=0

5MD5 · Capsid protein P24: “The structure of the mature HIV-1 ca hexameric lattice with curvature parameters: TILT=11, TWIST=0”. Electron microscopy, 15 pockets (best druggability 0.36). MolNFT v1 #126781 on GenesisL1: 3D structure…

PDB
5MD5
Type
protein
Length
1,474 residues
Chains
14
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Capsid protein P24
UniProt
A0A0K0V8J8, E9MJT0
Pockets
15 · best druggability 0.36

Structure

electron microscopy · 2 distinct chains · 60% helix, 3% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, F, W, C, D, E, GCapsid protein P24protein7464% helix, 0% strandA0A0K0V8J8
a, b, f, H, I, JCapsid protein P24protein14758% helix, 4% strandE9MJT0

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11400.360.7329empty
21490.360.7234empty
31250.340.7229empty
41110.340.7330empty
51050.320.7326empty

Interfaces

15 interfaces between chains.

  • B–b · 65 Ų buried · 1 hydrogen bond · protein-protein
  • D–I · 64 Ų buried · 1 hydrogen bond · protein-protein
  • F–f · 63 Ų buried · 2 hydrogen bonds · protein-protein
  • C–H · 62 Ų buried · 2 hydrogen bonds · protein-protein
  • E–J · 62 Ų buried · 2 hydrogen bonds · protein-protein

Compared structures

  • 5MD5 · The structure of the mature HIV-1 CA hexameric lattice with curvature parameters… · the same entry in another collection · chain A against A, TM-score 1.00

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