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Crystal structure of multidrug resistant HIV-1 protease clinical isolate PR20D25N with open flap

Analyse Crystal structure of multidrug resistant HIV-1 protease clinical isolate… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4Z4X
Type
protein
Length
198 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Protease
UniProt
Q0PQ60
Pockets
1 · best druggability 0.59

Structure

x-ray diffraction · 1 distinct chain · 7% helix, 54% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BProteaseprotein997% helix, 54% strandQ0PQ60

Pockets

1 pocket found on a 1 Å grid, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15050.590.7348empty

Interfaces

1 interface between chains.

  • A–B · 1563 Ų buried · 34 hydrogen bonds · protein-protein

Compared structures

  • 4Z4X · Crystal Structure of Multidrug Resistant HIV-1 Protease Clinical Isolate PR20D25N with… · the same entry in another collection · chain A against A, TM-score 1.00

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