4C9X: Crystal structure of NUDT1 (MTH1) with S-crizotinib

PDB ID: 4C9XDownload
MMDB ID: 118733
PDB Deposition Date: 2013/10/3
Updated in MMDB: 2023/12
Experimental Method:
x-ray diffraction
Resolution: 1.2  Å
Source Organism:
Similar Structures:
Biological Unit for 4C9X: dimeric; determined by author and by software (PISA)
Molecular Components in 4C9X
Label Count Molecule
Proteins (2 molecules)
2
7,8-dihydro-8-oxoguanine Triphosphatase
(Gene symbol: NUDT1)
Molecule annotation
Chemicals and Non-standard biopolymers (13 molecules)
1
2
3-[(1S)-1-(2,6-DICHLORO-3-FLUOROPHENYL)ETHOXY]-5-(1-PIPERIDIN-4-YLPYRAZOL-4-YL)PYRIDIN-2-AMINE3-[(1S)-1-(2,6-DICHLORO-3-FLUOROPHENYL)ETHOXY]-5-(1-PIPERIDIN-4-YLPYRAZOL-4-YL)PYRIDIN-2-AMINE
2
2
CHLORIDE IONCHLORIDE ION
3
9
SULFATE IONSULFATE ION
* Click molecule labels to explore molecular sequence information.
Citing MMDB
Madej T, Lanczycki CJ, Zhang D, Thiessen PA, Geer RC, Marchler-Bauer A, Bryant SH. " MMDB and VAST+: tracking structural similarities between macromolecular complexes. Nucleic Acids Res. 2014 Jan; 42(Database issue):D297-303