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Crystal structure of a complex between human serum albumin and the antibody Fab SL335

Analyse Crystal structure of a complex between human serum albumin and the antibody Fab… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6M58
Type
protein
Length
1,956 residues
Chains
6
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
2.95
Source
Homo sapiens; SYNTHETIC CONSTRUCT
Molecule
Serum albumin; Heavy chain of the SL335 antibody fab; Light chain of the SL335 antibody…
UniProt
P02768
Pockets
20 · best druggability 0.84

Structure

x-ray diffraction · resolution 2.95 · 5 distinct chains · 49% helix, 19% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ASerum albuminprotein56174% helix, 0% strandP02768
HHeavy chain of the SL335 antibody fabprotein2126% helix, 53% strand—
L, DLight chain of the SL335 antibody Fabprotein2117% helix, 50% strand—
BSerum albuminprotein55073% helix, 0% strandP02768
CHeavy chain of the SL335 antibody fabprotein2117% helix, 53% strand—

Pockets

20 pockets found on a 1 Å grid, 15 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16460.840.8866empty
211890.840.84118empty
311120.820.84139empty
4920.770.9824empty
5940.760.9826empty

Interfaces

10 interfaces between chains.

  • C–D · 1629 Ų buried · 16 hydrogen bonds · protein-protein
  • H–L · 1596 Ų buried · 15 hydrogen bonds · protein-protein
  • B–C · 823 Ų buried · 9 hydrogen bonds · protein-protein
  • A–H · 780 Ų buried · 9 hydrogen bonds · protein-protein
  • L–B · 580 Ų buried · 7 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 36 disulfide (disulfide).

Compared structures

  • 6M58 · Crystal structure of a complex between human serum albumin and the antibody Fab SL335 · the same entry in another collection · chain L against L, TM-score 1.00
  • P02768 · AlphaFold monomer V2.0 prediction for albumin (P02768) · a predicted model of the same protein · chain A against A, TM-score 0.98

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