PDBsum entry 5tqf

Hydrolase/hydrolase inhibitor

PDB id: 5tqf

Contents

Protein chains

250 a.a.

55 a.a.

Ligands

7KR

SO4 ×4

GOL ×3

Metals

_CA

Waters ×367

PDB id:

5tqf

Name:

Hydrolase/hydrolase inhibitor

Title:

Factor viia in complex with the inhibitor (11r)-11-[(1- aminoisoquinolin-6-yl)amino]-16-(cyclopropylsulfonyl)-13-methyl-2,13- diazatricyclo[13.3.1.1~6,10~]icosa-1(19),6(20),7,9,15,17-hexaene-3, 12-dione

Structure:

Factor viia (heavy chain). Chain: h. Synonym: proconvertin,serum prothrombin conversion accelerator,spca, activated factor viia heavy chain. Engineered: yes. Factor viia (light chain). Chain: l. Synonym: proconvertin,serum prothrombin conversion accelerator,spca. Engineered: yes

Source:

Homo sapiens. Human. Organism_taxid: 9606. Gene: f7. Expressed in: cricetinae. Expression_system_taxid: 10026. Expression_system_taxid: 10026

Resolution:

1.85Å R-factor: 0.184 R-free: 0.209

Authors:

A.Wei

Key ref:

J.M.Richter et al. (2017). Design and Synthesis of Novel Meta-Linked Phenylglycine Macrocyclic FVIIa Inhibitors. Acs Med Chem Lett, 8, 67-72. PubMed id: 28105277 DOI: 10.1021/acsmedchemlett.6b00375

Date:

24-Oct-16 Release date: 01-Feb-17

Protein chain

P08709  (FA7_HUMAN) -  Coagulation factor VII from Homo sapiens

Seq: 466 a.a.

Struc: 250 a.a.

Protein chain

P08709  (FA7_HUMAN) -  Coagulation factor VII from Homo sapiens

Seq: 466 a.a.

Struc: 55 a.a.

Enzyme reactions

• Enzyme class: Chains H, L: E.C.3.4.21.21 - coagulation factor VIIa.
• Reaction: Hydrolyzes one Arg-|-Ile bond in factor X to form factor Xa.

DOI no: 10.1021/acsmedchemlett.6b00375

Acs Med Chem Lett 8:67-72 (2017)

PubMed id: 28105277

Design and Synthesis of Novel Meta-Linked Phenylglycine Macrocyclic FVIIa Inhibitors.

J.M.Richter, D.L.Cheney, J.A.Bates, A.Wei, J.M.Luettgen, A.R.Rendina, T.M.Harper, R.Narayanan, P.C.Wong, D.Seiffert, R.R.Wexler, E.S.Priestley.

ABSTRACT

No abstract given.