7G7M: Crystal Structure of rat Autotaxin in complex with N-[(3,4-dichlorophenyl)methyl]-N-methyl-2-[4-oxo-6-[4-(1,3-thiazol-2-yl)piperazin-1-yl]quinazolin-3-yl]acetamide, i.e. SMILES N1=C(SC=C1)N1CCN(CC1)c1ccc2N=CN(CC(=O)N(C)Cc3ccc(c(c3)Cl)Cl)C(=O)c2c1 with IC5

PDB ID: 7G7MDownload
MMDB ID: 256831
PDB Deposition Date: 2023/6/5
Updated in MMDB: 2024/12
Experimental Method:
x-ray diffraction
Resolution: 1.69  Å
Source Organism:
Similar Structures:
Biological Unit for 7G7M: monomeric; determined by author and by software (PISA)
Molecular Components in 7G7M
Label Count Molecule
Protein (1 molecule)
1
Isoform 2 of Ectonucleotide Pyrophosphatase/phosphodiesterase Family Member 2
(Gene symbol: Enpp2)
Molecule annotation
Chemicals and Non-standard biopolymers (15 molecules)
1
2
2-acetamido-2-deoxy-beta-D-glucopyranose2-acetamido-2-deoxy-beta-D-glucopyranose
2
1
beta-D-mannopyranosebeta-D-mannopyranose
3
5
alpha-D-mannopyranosealpha-D-mannopyranose
4
1
N-[(3,4-dichlorophenyl)methyl]-N-methyl-2-{4-oxo-6-[4-(1,3-thiazol-2-yl)piperazin-1-yl]quinazolin-3(4H)-yl}acetamideN-[(3,4-dichlorophenyl)methyl]-N-methyl-2-{4-oxo-6-[4-(1,3-thiazol-2-yl)piperazin-1-yl]quinazolin-3(4H)-yl}acetamide
5
1
CHLORIDE IONCHLORIDE ION
6
1
ACETATE IONACETATE ION
7
1
ZINC IONZINC ION
8
2
SODIUM IONSODIUM ION
9
1
CALCIUM IONCALCIUM 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