› 7gyx

X-ray diffraction
2.15Å resolution

Crystal Structure of HSP72 in complex with ligand 11 at 21.45 MGy X-ray dose

Released:
DOI: 10.2210/pdb7gyx/pdb
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PDB entry 7gyx coloured by chain, front view.
PDB entry 7gyx coloured by chain, side view.
PDB entry 7gyx coloured by chain, top view.
Source organism: Homo sapiens
Primary publication:
Specific radiation damage to halogenated inhibitors and ligands in protein-ligand crystal structures.
Rodrigues MJ, Cabry M, Collie G, Carter M, McAndrew C, Owen RL, Bellenie BR, Le Bihan YV, van Montfort RLM
J Appl Crystallogr 57 1951-1965 (2024)
PMID: 39628887

Function and Biology Details

Biochemical function:
  • not assigned
Biological process:
  • not assigned
Cellular component:
  • not assigned

Structure analysis Details

Assembly composition:
monomeric (preferred)
Assembly name:
PDBe Complex ID:
PDB-CPX-143649 (preferred)
Entry contents:
1 distinct polypeptide molecule
Macromolecule:
Heat shock 70 kDa protein 1A Chain: A
Molecule details ›
Chain: A
Length: 394 amino acids
Theoretical weight: 43.2 KDa
Source organism: Homo sapiens
Expression system: Escherichia coli
UniProt:
  • Canonical: P0DMV8 (Residues: 1-380; Coverage: 59%)
Gene names: HSP72, HSPA1, HSPA1A, HSX70
Sequence domains: Hsp70 protein

Ligands and Environments

6 bound ligands:
Ligand PO4 4 x PO4
Ligand DMS 3 x DMS
Ligand EDO 5 x EDO
Ligand PEG 1 x PEG
Ligand 1PS 1 x 1PS
Ligand A1ACZ 1 x A1ACZ
No modified residues

Experiments and Validation Details

wwPDB Validation report is not available for this entry.
X-ray source: DIAMOND BEAMLINE I24
Spacegroup: P212121
Unit cell:
a: 52.13Å b: 82.63Å c: 94.13Å
α: 90° β: 90° γ: 90°
R-values:
R R work R free
0.177 0.174 0.232
Expression system: Escherichia coli

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