4U01

HCV NS3/4A serine protease in complex with 6570

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0006508	biological_process	proteolysis
A	0008236	molecular_function	serine-type peptidase activity
A	0019087	biological_process	symbiont-mediated transformation of host cell
B	0006508	biological_process	proteolysis
B	0008236	molecular_function	serine-type peptidase activity
B	0019087	biological_process	symbiont-mediated transformation of host cell
C	0006508	biological_process	proteolysis
C	0008236	molecular_function	serine-type peptidase activity
C	0019087	biological_process	symbiont-mediated transformation of host cell
D	0006508	biological_process	proteolysis
D	0008236	molecular_function	serine-type peptidase activity
D	0019087	biological_process	symbiont-mediated transformation of host cell
E	0006508	biological_process	proteolysis
E	0008236	molecular_function	serine-type peptidase activity
E	0019087	biological_process	symbiont-mediated transformation of host cell
F	0006508	biological_process	proteolysis
F	0008236	molecular_function	serine-type peptidase activity
F	0019087	biological_process	symbiont-mediated transformation of host cell
G	0006508	biological_process	proteolysis
G	0008236	molecular_function	serine-type peptidase activity
G	0019087	biological_process	symbiont-mediated transformation of host cell
H	0006508	biological_process	proteolysis
H	0008236	molecular_function	serine-type peptidase activity
H	0019087	biological_process	symbiont-mediated transformation of host cell
J	0006508	biological_process	proteolysis
J	0008236	molecular_function	serine-type peptidase activity
J	0019087	biological_process	symbiont-mediated transformation of host cell

Functional Information from PDB Data

site_id	AC1
Number of Residues	17
Details	binding site for residue 39W A 301

Chain	Residue
A	PHE43
A	SER139
A	PHE154
A	ARG155
A	ALA156
A	ALA157
A	CYS159
D	ASP79
D	39W301
A	HIS57
A	GLY58
A	ASP79
A	ASP81
A	VAL132
A	LYS136
A	GLY137
A	SER138

---

site_id	AC2
Number of Residues	4
Details	binding site for residue ZN A 302

Chain	Residue
A	CYS97
A	CYS99
A	CYS145
A	SER147

---

site_id	AC3
Number of Residues	17
Details	binding site for residue 39W B 301

Chain	Residue
B	SER42
B	PHE43
B	HIS57
B	ASP79
B	VAL132
B	LEU135
B	LYS136
B	GLY137
B	SER138
B	SER139
B	PHE154
B	ARG155
B	ALA156
B	ALA157
F	VAL78
F	ASP79
F	39W301

---

site_id	AC4
Number of Residues	4
Details	binding site for residue ZN B 302

Chain	Residue
B	CYS97
B	THR98
B	CYS99
B	CYS145

---

site_id	AC5
Number of Residues	18
Details	binding site for residue 39W C 301

Chain	Residue
C	PHE43
C	TYR56
C	HIS57
C	GLY58
C	ASP79
C	ASP81
C	VAL132
C	LYS136
C	GLY137
C	SER138
C	SER139
C	PHE154
C	ARG155
C	ALA156
C	ALA157
E	VAL78
E	ASP79
E	39W301

---

site_id	AC6
Number of Residues	3
Details	binding site for residue ZN C 302

Chain	Residue
C	CYS97
C	CYS99
C	CYS145

---

site_id	AC7
Number of Residues	19
Details	binding site for residue 39W D 301

Chain	Residue
A	VAL78
A	ASP79
A	39W301
D	GLN41
D	PHE43
D	HIS57
D	GLY58
D	ASP79
D	GLN80
D	ASP81
D	VAL132
D	LYS136
D	GLY137
D	SER138
D	SER139
D	PHE154
D	ARG155
D	ALA156
D	ALA157

---

site_id	AC8
Number of Residues	4
Details	binding site for residue ZN D 302

Chain	Residue
D	CYS97
D	CYS99
D	CYS145
D	SER147

---

site_id	AC9
Number of Residues	1
Details	binding site for residue CL D 303

Chain	Residue
D	SER37

---

site_id	AD1
Number of Residues	17
Details	binding site for residue 39W E 301

Chain	Residue
E	SER138
E	SER139
E	PHE154
E	ARG155
E	ALA157
C	39W301
E	PHE43
E	TYR56
E	HIS57
E	GLY58
E	ASP79
E	GLN80
E	ASP81
E	VAL132
E	LEU135
E	LYS136
E	GLY137

---

site_id	AD2
Number of Residues	4
Details	binding site for residue ZN E 302

Chain	Residue
E	CYS97
E	CYS99
E	CYS145
E	SER147

---

site_id	AD3
Number of Residues	19
Details	binding site for residue 39W F 301

Chain	Residue
B	39W301
F	GLN41
F	PHE43
F	TYR56
F	HIS57
F	GLY58
F	ASP79
F	GLN80
F	ASP81
F	VAL132
F	LEU135
F	LYS136
F	GLY137
F	SER138
F	SER139
F	PHE154
F	ARG155
F	ALA156
F	ALA157

---

site_id	AD4
Number of Residues	3
Details	binding site for residue ZN F 302

Chain	Residue
F	CYS97
F	CYS99
F	CYS145

---

site_id	AD5
Number of Residues	16
Details	binding site for residue 39W G 301

Chain	Residue
G	PHE43
G	HIS57
G	ASP79
G	ASP81
G	VAL132
G	LYS136
G	GLY137
G	SER138
G	SER139
G	PHE154
G	ARG155
G	ALA156
G	ALA157
H	VAL78
H	ASP79
H	39W301

---

site_id	AD6
Number of Residues	4
Details	binding site for residue ZN G 302

Chain	Residue
G	CYS97
G	THR98
G	CYS99
G	CYS145

---

site_id	AD7
Number of Residues	19
Details	binding site for residue 39W H 301

Chain	Residue
G	VAL78
G	ASP79
G	39W301
H	GLN41
H	PHE43
H	TYR56
H	HIS57
H	ASP79
H	ASP81
H	VAL132
H	LEU135
H	LYS136
H	GLY137
H	SER138
H	SER139
H	PHE154
H	ARG155
H	ALA156
H	ALA157

---

site_id	AD8
Number of Residues	3
Details	binding site for residue ZN H 302

Chain	Residue
H	CYS97
H	CYS99
H	CYS145

---

site_id	AD9
Number of Residues	21
Details	binding site for residue 39W J 301

Chain	Residue
J	GLN41
J	PHE43
J	TYR56
J	HIS57
J	GLY58
J	VAL78
J	ASP79
J	ASP79
J	GLN80
J	ASP81
J	VAL132
J	LEU135
J	LYS136
J	GLY137
J	SER138
J	SER139
J	PHE154
J	ARG155
J	ALA156
J	ALA157
J	CYS159

---

site_id	AE1
Number of Residues	5
Details	binding site for residue ZN J 302

Chain	Residue
J	CYS97
J	CYS99
J	GLY100
J	SER101
J	CYS145

---

Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI2
Number of Residues	27
Details	Active site: {"description":"Charge relay system; for serine protease NS3 activity","evidences":[{"source":"PROSITE-ProRule","id":"PRU01166","evidenceCode":"ECO:0000255"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI3
Number of Residues	27
Details	Binding site: {"evidences":[{"source":"PROSITE-ProRule","id":"PRU01166","evidenceCode":"ECO:0000255"},{"source":"PubMed","id":"26410074","evidenceCode":"ECO:0000269"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI4
Number of Residues	9
Details	Binding site: {"evidences":[{"source":"PROSITE-ProRule","id":"PRU01166","evidenceCode":"ECO:0000255"}]}

Chain

Residue

Details

---