4JYU

Structure of factor VIIA in complex with the inhibitor (2R)-2-[(1-AMINOISOQUINOLIN-6-YL)AMINO]-2-[3-ETHOXY-4-(PROPAN-2-YLOXY)PHENYL]-N-(PHENYLSULFONYL)ETHANAMIDE

Functional Information from GO Data

Chain	GOid	namespace	contents
H	0004252	molecular_function	serine-type endopeptidase activity
H	0006508	biological_process	proteolysis

Functional Information from PDB Data

site_id	AC1
Number of Residues	22
Details	BINDING SITE FOR RESIDUE 1OK H 301

Chain	Residue
H	HIS57
H	SER195
H	VAL213
H	SER214
H	TRP215
H	GLY216
H	GLY219
H	CYS220
H	GLY226
H	GOL307
H	GOL310
H	ASP60
H	HOH525
H	HOH667
H	HOH668
H	THR98
H	THR99
H	ASP102
H	PRO170
H	ASP189
H	SER190
H	LYS192

---

site_id	AC2
Number of Residues	6
Details	BINDING SITE FOR RESIDUE CA H 302

Chain	Residue
H	GLU70
H	ASP72
H	GLU75
H	GLU80
H	HOH665
H	HOH666

---

site_id	AC3
Number of Residues	4
Details	BINDING SITE FOR RESIDUE SO4 H 303

Chain	Residue
H	ARG83
H	ARG84
H	HIS109
H	GLN110

---

site_id	AC4
Number of Residues	6
Details	BINDING SITE FOR RESIDUE SO4 H 304

Chain	Residue
H	VAL35
H	ASN37
H	LYS60
H	ILE60
H	LYS60
H	ASN60

---

site_id	AC5
Number of Residues	6
Details	BINDING SITE FOR RESIDUE SO4 H 305

Chain	Residue
H	SER170
H	ILE176
H	GLN217
H	HIS224
H	PHE225
H	VAL227

---

site_id	AC6
Number of Residues	7
Details	BINDING SITE FOR RESIDUE SO4 H 306

Chain	Residue
H	ILE47
H	ASN48
H	GLN239
H	HOH411
H	HOH670
H	HOH696
L	HIS115

---

site_id	AC7
Number of Residues	8
Details	BINDING SITE FOR RESIDUE GOL H 307

Chain	Residue
H	LEU41
H	CYS42
H	HIS57
H	CYS58
H	SER195
H	1OK301
H	GOL310
H	HOH673

---

site_id	AC8
Number of Residues	8
Details	BINDING SITE FOR RESIDUE GOL H 308

Chain	Residue
H	PHE59
H	ASP60
H	TRP61
H	PRO96
H	ARG147
H	LEU251
H	HOH420
H	HOH482

---

site_id	AC9
Number of Residues	5
Details	BINDING SITE FOR RESIDUE GOL H 309

Chain	Residue
H	GLU26
H	CYS27
H	LEU137
H	HOH658
L	ILE138

---

site_id	BC1
Number of Residues	8
Details	BINDING SITE FOR RESIDUE GOL H 310

Chain	Residue
H	GLN40
H	GLN143
H	LYS192
H	GLY193
H	1OK301
H	GOL307
H	HOH488
H	HOH637

---

Functional Information from PROSITE/UniProt

site_id	PS00134
Number of Residues	6
Details	TRYPSIN_HIS Serine proteases, trypsin family, histidine active site. VSAAHC

Chain	Residue	Details
H	VAL53-CYS58

---

site_id	PS00135
Number of Residues	12
Details	TRYPSIN_SER Serine proteases, trypsin family, serine active site. DSckGDSGGPHA

Chain	Residue	Details
H	ASP189-ALA200

---

site_id	PS01186
Number of Residues	16
Details	EGF_2 EGF-like domain signature 2. CrCheGYslladgvsC

Chain	Residue	Details
L	CYS112-CYS127

---

Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	239
Details	Domain: {"description":"Peptidase S1","evidences":[{"source":"PROSITE-ProRule","id":"PRU00274","evidenceCode":"ECO:0000255"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI2
Number of Residues	3
Details	Active site: {"description":"Charge relay system","evidences":[{"evidenceCode":"ECO:0000250"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI3
Number of Residues	1
Details	Binding site: {"evidences":[{"evidenceCode":"ECO:0000250"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI4
Number of Residues	1
Details	Glycosylation: {"description":"N-linked (GlcNAc...) asparagine","evidences":[{"source":"PubMed","id":"19167329","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"3264725","evidenceCode":"ECO:0000269"}]}

Chain

Residue

Details

---