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Crystal structure of C11 Fab, an adcc mediating anti-HIV-1 antibody.

Analyse Crystal structure of C11 Fab, an adcc mediating anti-HIV-1 antibody. in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4FZ8
Type
protein
Length
437 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Fab heavy chain of human anti-HIV-1 env antibody C11; Fab light chain of human anti-HIV-1…
Ligands
NAG, ZN
Pockets
5 · best druggability 0.48

Structure

x-ray diffraction · 2 distinct chains · 4% helix, 45% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
HFab heavy chain of human anti-HIV-1 env antibody C11protein2225% helix, 40% strand—
LFab light chain of human anti-HIV-1 env antibody C11protein2153% helix, 50% strand—

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · chains H
  • ZN · Zinc ion · metal · chains H, L

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12480.480.7435empty
21410.400.7324empty
31350.390.7421empty
4600.320.7613empty
5850.310.7318empty

Interfaces

1 interface between chains.

  • H–L · 1869 Ų buried · 21 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 4 disulfide, 1 glycan (disulfide, N-glycosylation).

Compared structures

  • 4FZ8 · Crystal structure of C11 Fab, an ADCC mediating anti-HIV-1 antibody. · the same entry in another collection · chain H against H, TM-score 1.00

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