6T9V: Bovine Trypsin in complex with the synthetic inhibitor (S)-3-(3-(4-(3-(tert-butyl)ureido)piperidin-1-yl)-2-((3'-fluoro-4'-(hydroxymethyl)-[1,1'-biphenyl])-3-sulfonamido)-3-oxopropyl)benzimidamide (MI-1904)

PDB ID: 6T9VDownload
MMDB ID: 204224
PDB Deposition Date: 2019/10/28
Updated in MMDB: 2024/12
Experimental Method:
x-ray diffraction
Resolution: 1.12643  Å
Source Organism:
Similar Structures:
Biological Unit for 6T9V: monomeric; determined by author and by software (PISA)
Molecular Components in 6T9V
Label Count Molecule
Protein (1 molecule)
1
Cationic Trypsin
(Gene symbol: PRSS1)
Molecule annotation
Chemicals and Non-standard biopolymers (5 molecules)
1
1
trifluoroacetic acidtrifluoroacetic acid
2
2
DIMETHYL SULFOXIDEDIMETHYL SULFOXIDE
3
1
CALCIUM IONCALCIUM ION
4
1
1-~{tert}-butyl-3-[1-[(2~{S})-3-(3-carbamimidoylphenyl)-2-[[3-[3-fluoranyl-4-(hydroxymethyl)phenyl]phenyl]sulfonylamino ]propanoyl]piperidin-4-yl]urea1-~{tert}-butyl-3-[1-[(2~{S})-3-(3-carbamimidoylphenyl)-2-[[3-[3-fluoranyl-4-(hydroxymethyl)phenyl]phenyl]sulfonylamino ]propanoyl]piperidin-4-yl]urea
* 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