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Structure of HIV-1 CACSP1NC MUTANT(W41A,M42A) interacting with maturation inhibitor EP39

Analyse Structure of HIV-1 CACSP1NC MUTANT(W41A,M42A) interacting with maturation… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6RWG
Type
protein
Length
157 residues
Chains
1
Method
solution nmr
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Gag polyprotein
UniProt
E7DAY8
Ligands
ZN
Pockets
2 · best druggability 0.44

Structure

solution nmr · 1 distinct chain · 48% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGag polyproteinprotein15748% helix, 0% strandE7DAY8

Ligands and binding sites

  • ZN · Zinc ion · metal · 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
12010.440.7325empty
2920.350.7315empty

Compared structures

  • 6RWG · Structure of HIV-1 CAcSP1NC mutant(W41A,M42A) interacting with maturation inhibitor EP39 · the same entry in another collection · chain A against A, TM-score 1.00

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