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Ca-targeting nanobody is a tool for studying HIV-1 capsid lattice interactions

Analyse Ca-targeting nanobody is a tool for studying HIV-1 capsid lattice interactions in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7N9U
Type
protein
Length
992 residues
Chains
6
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Capsid protein; Nanobody
UniProt
B6DRA0
Pockets
9 · best druggability 0.68

Structure

x-ray diffraction · 5 distinct chains · 45% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACapsid proteinprotein21459% helix, 3% strandB6DRA0
BCapsid proteinprotein21460% helix, 3% strandB6DRA0
CCapsid proteinprotein21959% helix, 3% strandB6DRA0
D, ENanobodyprotein1165% helix, 51% strand—
FNanobodyprotein1135% helix, 53% strand—

Pockets

9 pockets found on a 1 Å grid, 4 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13740.680.8161empty
23100.650.8148empty
33160.550.7544empty
4950.510.8219empty
5890.490.8221empty

Interfaces

7 interfaces between chains.

  • A–B · 1237 Ų buried · 9 hydrogen bonds · protein-protein
  • B–C · 1138 Ų buried · 8 hydrogen bonds · protein-protein
  • A–E · 707 Ų buried · 11 hydrogen bonds · protein-protein
  • B–F · 662 Ų buried · 13 hydrogen bonds · protein-protein
  • C–D · 660 Ų buried · 12 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 8 disulfide (disulfide).

Compared structures

  • 7N9U · CA-targeting nanobody is a tool for studying HIV-1 capsid lattice interactions · the same entry in another collection · chain A against A, TM-score 1.00

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