Reaction Details Report a problem with these data
Target
Coagulation factor VII
Ligand
BDBM14911
Substrate
BDBM13777
Meas. Tech.
Enzyme Inhibition Assay
pH
7.4±n/a
Temperature
295.15±n/a K
Ki
29±n/a nM
Citation
 Shrader, WD; Kolesnikov, A; Burgess-Henry, J; Rai, R; Hendrix, J; Hu, H; Torkelson, S; Ton, T; Young, WB; Katz, BA; Yu, C; Tang, J; Cabuslay, R; Sanford, E; Janc, JW; Sprengeler, PA Factor VIIa inhibitors: gaining selectivity within the trypsin family. Bioorg Med Chem Lett 16:1596-600 (2006) [PubMed]  Article 
Target
Name:
Coagulation factor VII
Synonyms:
Eptacog alfa | F7 | FA7_HUMAN | Factor VIIa | Factor VIIa (fVIIa) | Proconvertin | SPCA | Thrombin and coagulation factor VII | serum prothrombin conversion accelerator
Type:
Enzyme
Mol. Mass.:
51599.89
Organism:
Homo sapiens (Human)
Description:
n/a
Residue:
466
Sequence:
MVSQALRLLCLLLGLQGCLAAGGVAKASGGETRDMPWKPGPHRVFVTQEEAHGVLHRRRRANAFLEELRPGSLERECKEEQCSFEEAREIFKDAERTKLFWISYSDGDQCASSPCQNGGSCKDQLQSYICFCLPAFEGRNCETHKDDQLICVNENGGCEQYCSDHTGTKRSCRCHEGYSLLADGVSCTPTVEYPCGKIPILEKRNASKPQGRIVGGKVCPKGECPWQVLLLVNGAQLCGGTLINTIWVVSAAHCFDKIKNWRNLIAVLGEHDLSEHDGDEQSRRVAQVIIPSTYVPGTTNHDIALLRLHQPVVLTDHVVPLCLPERTFSERTLAFVRFSLVSGWGQLLDRGATALELMVLNVPRLMTQDCLQQSRKVGDSPNITEYMFCAGYSDGSKDSCKGDSGGPHATHYRGTWYLTGIVSWGQGCATVGHFGVYTRVSQYIEWLQKLMRSEPRPGVLLRAPFP
  
Inhibitor
Name:
BDBM14911
Synonyms:
2-[3-(5-carbamimidoyl-1H-1,3-benzodiazol-2-yl)-5-(3,5-dimethylphenyl)-4-hydroxyphenyl]butanedioic acid | 5-amidino benzimidazole analog 22
Type:
Small organic molecule
Emp. Form.:
C26H24N4O5
Mol. Mass.:
472.4926
SMILES:
Cc1cc(C)cc(c1)-c1cc(cc(-c2nc3ccc(cc3[nH]2)C(N)=N)c1O)C(CC(O)=O)C(O)=O
Structure:
Search PDB for entries with ligand similarity:
Substrate
Name:
BDBM13777
Synonyms:
(2S)-5-carbamimidamido-2-{2-[(2R)-3-cyclohexyl-2-methanesulfonamidopropanamido]butanamido}-N-(4-nitrophenyl)pentanamide; acetic acid | CH3SO2-D-CHA-But-Arg-pNA. AcOH | Pefachrome FVIIa
Type:
Small organic molecule
Emp. Form.:
C26H42N8O7S
Mol. Mass.:
610.726
SMILES:
CCC(NC(=O)C(CC1CCCCC1)NS(C)(=O)=O)C(=O)NC(CCC\[NH+]=C(\N)[NH-])C(=O)Nc1ccc(cc1)[N+]([O-])=O
Structure:
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