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Crystal structure of RV144-elicited antibody CH58

Analyse Crystal structure of RV144-elicited antibody CH58 in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4HQQ
Type
protein
Length
427 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
CH58 Fab heavy chain; CH58 Fab light chain
Pockets
3 · best druggability 0.39

Structure

x-ray diffraction · 2 distinct chains · 7% helix, 52% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
HCH58 Fab heavy chainprotein2157% helix, 54% strand—
LCH58 Fab light chainprotein2128% helix, 50% strand—

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11330.390.7428empty
21100.350.7321empty
3570.290.7410empty

Interfaces

1 interface between chains.

  • H–L · 1710 Ų buried · 15 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 4 disulfide (disulfide).

Compared structures

  • 4HQQ · Crystal structure of RV144-elicited antibody CH58 · the same entry in another collection · chain H against H, TM-score 1.00

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