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Reaction Details
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TargetCoagulation factor X
LigandBDBM19025
Substrate/CompetitorBDBM12500
Meas. Tech.Enzyme Assay and Determination of the Inhibition Constants.
pH7±n/a
Temperature295.15±n/a K
Ki 5.7±n/a nM
Citation Qiao, JXCheng, XSmallheer, JMGalemmo, RADrummond, SPinto, DJCheney, DLHe, KWong, PCLuettgen, JMKnabb, RMWexler, RRLam, PY Pyrazole-based factor Xa inhibitors containing N-arylpiperidinyl P4 residues. Bioorg Med Chem Lett17:1432-7 (2007) [PubMed]  Article
More Info.:Get all data from this article,   Solution Info,  Assay Method
 
Coagulation factor X
Name:Coagulation factor X
Synonyms:Activated coagulation factor X (FXa) | Activated factor Xa heavy chain | Coagulation factor X precursor | Coagulation factor Xa | F10 | FA10_HUMAN | Factor X heavy chain | Factor X light chain | Factor Xa | Stuart factor | Stuart-Prower factor
Type:Enzyme
Mol. Mass.:54726.60
Organism:Homo sapiens (Human)
Description:n/a
Residue:488
Sequence:
MGRPLHLVLLSASLAGLLLLGESLFIRREQANNILARVTRANSFLEEMKKGHLERECMEE
TCSYEEAREVFEDSDKTNEFWNKYKDGDQCETSPCQNQGKCKDGLGEYTCTCLEGFEGKN
CELFTRKLCSLDNGDCDQFCHEEQNSVVCSCARGYTLADNGKACIPTGPYPCGKQTLERR
KRSVAQATSSSGEAPDSITWKPYDAADLDPTENPFDLLDFNQTQPERGDNNLTRIVGGQE
CKDGECPWQALLINEENEGFCGGTILSEFYILTAAHCLYQAKRFKVRVGDRNTEQEEGGE
AVHEVEVVIKHNRFTKETYDFDIAVLRLKTPITFRMNVAPACLPERDWAESTLMTQKTGI
VSGFGRTHEKGRQSTRLKMLEVPYVDRNSCKLSSSFIITQNMFCAGYDTKQEDACQGDSG
GPHVTRFKDTYFVTGIVSWGEGCARKGKYGIYTKVTAFLKWIDRSMKTRGLPKAKSHAPE
VITSSPLK
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  Blast E-value cutoff:
BDBM19025
BDBM12500
NameBDBM19025
Synonyms:1-[3-(aminomethyl)phenyl]-N-[4-(2-methanesulfonylphenyl)cyclohexyl]-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide | DPC 423 derivative, 5
TypeSmall organic molecule
Emp. Form.C25H27F3N4O3S
Mol. Mass.520.567
SMILESCS(=O)(=O)c1ccccc1[C@H]1CC[C@@H](CC1)NC(=O)c1cc(nn1-c1cccc(CN)c1)C(F)(F)F |r,wU:13.17,wD:10.10,(6.57,7.3,;6.57,5.76,;5.03,5.76,;8.11,5.76,;6.57,4.22,;7.9,3.45,;7.9,1.91,;6.57,1.14,;5.24,1.91,;5.24,3.45,;3.9,4.22,;3.9,5.76,;2.57,6.53,;1.24,5.76,;1.24,4.22,;2.57,3.45,;-.23,6.23,;-1.37,5.2,;-1.05,3.69,;-2.84,5.68,;-3.31,7.14,;-4.85,7.14,;-5.33,5.68,;-4.08,4.77,;-4.08,3.23,;-2.75,2.46,;-2.75,.92,;-4.08,.15,;-5.42,.92,;-6.75,.15,;-8.08,.92,;-5.42,2.46,;-5.76,8.39,;-6.53,9.72,;-4.47,9.23,;-7.05,7.55,)|
Structure
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