› 2bxm

X-ray diffraction
2.5Å resolution

Human serum albumin complexed with myristate and indomethacin

Released:
DOI: 10.2210/pdb2bxm/pdb
PDB entry 2bxm coloured by chain, front view.
PDB entry 2bxm coloured by chain, side view.
PDB entry 2bxm coloured by chain, top view.
Source organism: Homo sapiens
Primary publication:
Structural basis of the drug-binding specificity of human serum albumin.
Ghuman J, Zunszain PA, Petitpas I, Bhattacharya AA, Otagiri M, Curry S
J Mol Biol 353 38-52 (2005)
PMID: 16169013

Function and Biology Details

Biochemical function:
Biological process:
Cellular component:
Sequence domains:
Structure domain:

Structure analysis Details

Assembly composition:
monomeric (preferred)
Assembly name:
PDBe Complex ID:
PDB-CPX-136176 (preferred)
Entry contents:
1 distinct polypeptide molecule
Macromolecule:
Albumin Chain: A
Molecule details ›
Chain: A
Length: 585 amino acids
Theoretical weight: 66.57 KDa
Source organism: Homo sapiens
Expression system: Komagataella pastoris
UniProt:
  • Canonical: P02768 (Residues: 25-609; Coverage: 99%)
Gene names: ALB, GIG20, GIG42, PRO0903, PRO1708, PRO2044, PRO2619, PRO2675, UNQ696/PRO1341
Sequence domains: Serum albumin family
Structure domains: Serum Albumin; Chain A, Domain 1

Ligands and Environments

2 bound ligands:
Ligand MYR 7 x MYR
Ligand IMN 2 x IMN
No modified residues

Experiments and Validation Details

Entry percentile scores
X-ray source: EMBL/DESY, HAMBURG BEAMLINE X13
Spacegroup: C2
Unit cell:
a: 188.141Å b: 38.821Å c: 96.052Å
α: 90° β: 105.18° γ: 90°
R-values:
R R work R free
0.201 0.201 0.247
Expression system: Komagataella pastoris

Quick links

Citations

91 review citations

The Halogen Bond.
Cavallo et al. (2016)
90 more

10 mentions without citation

Pharmaceutical strategies for preventing toxicity and promoting antioxidant and anti-inflammatory actions of bilirubin.
Nocentini et al. (2022)
9 more