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MolNFT v1 · #157160 · protein

Structure of HIV-1 ca P207S

6MQA · Capsid protein: “Structure of HIV-1 ca P207S”. X-ray diffraction, 2 ligands (IOD, CL), 2 pockets (best druggability 0.31). MolNFT v1 #157160 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6MQA
Type
protein
Length
214 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Capsid protein
UniProt
B6DRA0
Ligands
IOD, CL
Pockets
2 · best druggability 0.31

Structure

x-ray diffraction · 1 distinct chain · 62% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACapsid proteinprotein21462% helix, 0% strandB6DRA0

Ligands and binding sites

  • IOD · Iodide ion · ion · 3 copies · chains A
  • CL · Chloride ion · ion · 2 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1620.310.7512empty
2530.290.7516empty

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 6MQA · Structure of HIV-1 CA P207S · the same entry in another collection · chain A against A, TM-score 1.00

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