PDB ID: 5Q0H
Hetero Atom Contents
The number of atoms exceeds 100,000. So, it can not be displayed here.
Select unit:
Select hetatm:
Select chain: Sequence
Data format:
Color scheme of protein:
Code | Name | Style | Show | Link | |
---|---|---|---|---|---|
9F1 | Methyl [(4r,5e,8s)-11-chloro-8-[(2,6-difluoro-4-methylbenzene-1-carbonyl)amino]-4-methyl-2-oxo-1,3,4,7,8,10-hexahydro-2h-12,9-(azeno)-1,10-benzodiazacyclotetradecin-15-yl]carbamate | PoSSuM | |||
EDO | 1,2-ethanediol | PoSSuM | |||
SO4 | Sulfate ion | PoSSuM |
Code | Name | Show |
---|
Code | Name | Emphasize |
---|
Code | Name | Show |
---|
Download interaction data: 5Q0H
Structure summary
Code : | 5Q0H PDBj RCSB PDB PDBe | ||||||||||||
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Header : | HYDROLASE/HYDROLASE inhibitor | ||||||||||||
Title : | FACTOR XIA IN COMPLEX WITH THE INHIBITOR methyl [(4R,5E,8S)-11-chloro-8-[(2,6-difluoro-4-methylbenzene-1-carbonyl)amino]-4-methyl-2-oxo-1,3,4,7,8,10-hexahydro-2H-12,9-(azeno)-1,10-benzodiazacyclotetradecin-15-yl]carbamate | ||||||||||||
Release Data : | 2017-07-12 | ||||||||||||
Compound : |
|
||||||||||||
Source : |
|
||||||||||||
Authors : | Sheriff, S. | ||||||||||||
Keywords : | HYDROLASE, SERINE PROTEASE, BLOOD COAGULATION FACTOR, PROTEIN INHIBITOR COMPLEX, HYDROLASE-HYDROLASE inhibitor complex | ||||||||||||
Exp. method : | X-RAY DIFFRACTION ( 2.5000 Å ) | ||||||||||||
Citation : |
Macrocyclic inhibitors of Factor XIa: Discovery of alkyl-substituted macrocyclic amide linkers with improved potency.
Corte, J.R.,Yang, W.,Fang, T.
et al.
PubMed: 28687203 Tetrahydroquinoline derivatives as potent and selective factor XIa inhibitors.
Quan, M.L.,Wong, P.C.,Wang, C.
et al.
PubMed: 24405333 Phenylimidazoles as potent and selective inhibitors of coagulation factor XIa with in vivo antithrombotic activity.
Hangeland, J.J.,Friends, T.J.,Rossi, K.A.
et al.
PubMed: 25405503 Pyridine and pyridinone-based factor XIa inhibitors.
Corte, J.R.,Fang, T.,Hangeland, J.J.
et al.
PubMed: 25592713 Structure-based design of inhibitors of coagulation factor XIa with novel P1 moieties.
Pinto, D.J.,Smallheer, J.M.,Corte, J.R.
et al.
PubMed: 25728130 Discovery of a Potent Parenterally Administered Factor XIa Inhibitor with Hydroxyquinolin-2(1H)-one as the P2' Moiety.
Hu, Z.,Wong, P.C.,Gilligan, P.J.
et al.
PubMed: 26005539 Novel phenylalanine derived diamides as Factor XIa inhibitors.
Smith, L.M.,Orwat, M.J.,Hu, Z.
et al.
PubMed: 26704266 Orally bioavailable pyridine and pyrimidine-based Factor XIa inhibitors: Discovery of the methyl N-phenyl carbamate P2 prime group.
Corte, J.R.,Fang, T.,Pinto, D.J.
et al.
PubMed: 27073051 Structure-Based Design of Macrocyclic Factor XIa Inhibitors: Discovery of the Macrocyclic Amide Linker.
Corte, J.R.,Fang, T.,Osuna, H.
et al.
PubMed: 28085275 |
Reaction
Chain : | A | ||||||||
---|---|---|---|---|---|---|---|---|---|
UniProt : | P03951 (FA11_HUMAN) | ||||||||
|