4CRD: Creating Novel F1 Inhibitors Through Fragment Based Lead Generation And Structure Aided Drug Design

PDB ID: 4CRDDownload
MMDB ID: 126819
PDB Deposition Date: 2014/2/26
Updated in MMDB: 2015/02
Experimental Method:
x-ray diffraction
Resolution: 2.1  Å
Source Organism:
Similar Structures:
Biological Unit for 4CRD: trimeric; determined by software (PISA)
Molecular Components in 4CRD
Label Count Molecule
Proteins (3 molecules)
3
Coagulation Factor XI
(Gene symbol: F11)
Molecule annotation
Chemicals and Non-standard biopolymers (8 molecules)
1
3
Methyl N-[4-[5-Chloro-2-[[3-[5-Chloro-2-(Tetrazol-1-Yl)phenyl]propanoylamino]methyl]-1h-Imidazol-4-Yl]phenyl]carbamateMethyl N-[4-[5-Chloro-2-[[3-[5-Chloro-2-(Tetrazol-1-Yl)phenyl]propanoylamino]methyl]-1h-Imidazol-4-Yl]phenyl]carbamate
2
5
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