3UY9

Bovine trypsin variant X(tripleGlu217Phe227) in complex with small molecule inhibitor

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0004175	molecular_function	endopeptidase activity
A	0004252	molecular_function	serine-type endopeptidase activity
A	0005515	molecular_function	protein binding
A	0005576	cellular_component	extracellular region
A	0005615	cellular_component	extracellular space
A	0006508	biological_process	proteolysis
A	0007586	biological_process	digestion
A	0008233	molecular_function	peptidase activity
A	0008236	molecular_function	serine-type peptidase activity
A	0016787	molecular_function	hydrolase activity
A	0046872	molecular_function	metal ion binding
A	0097180	cellular_component	serine protease inhibitor complex
A	0097655	molecular_function	serpin family protein binding
B	0004175	molecular_function	endopeptidase activity
B	0004252	molecular_function	serine-type endopeptidase activity
B	0005515	molecular_function	protein binding
B	0005576	cellular_component	extracellular region
B	0005615	cellular_component	extracellular space
B	0006508	biological_process	proteolysis
B	0007586	biological_process	digestion
B	0008233	molecular_function	peptidase activity
B	0008236	molecular_function	serine-type peptidase activity
B	0016787	molecular_function	hydrolase activity
B	0046872	molecular_function	metal ion binding
B	0097180	cellular_component	serine protease inhibitor complex
B	0097655	molecular_function	serpin family protein binding
C	0004175	molecular_function	endopeptidase activity
C	0004252	molecular_function	serine-type endopeptidase activity
C	0005515	molecular_function	protein binding
C	0005576	cellular_component	extracellular region
C	0005615	cellular_component	extracellular space
C	0006508	biological_process	proteolysis
C	0007586	biological_process	digestion
C	0008233	molecular_function	peptidase activity
C	0008236	molecular_function	serine-type peptidase activity
C	0016787	molecular_function	hydrolase activity
C	0046872	molecular_function	metal ion binding
C	0097180	cellular_component	serine protease inhibitor complex
C	0097655	molecular_function	serpin family protein binding
D	0004175	molecular_function	endopeptidase activity
D	0004252	molecular_function	serine-type endopeptidase activity
D	0005515	molecular_function	protein binding
D	0005576	cellular_component	extracellular region
D	0005615	cellular_component	extracellular space
D	0006508	biological_process	proteolysis
D	0007586	biological_process	digestion
D	0008233	molecular_function	peptidase activity
D	0008236	molecular_function	serine-type peptidase activity
D	0016787	molecular_function	hydrolase activity
D	0046872	molecular_function	metal ion binding
D	0097180	cellular_component	serine protease inhibitor complex
D	0097655	molecular_function	serpin family protein binding
E	0004175	molecular_function	endopeptidase activity
E	0004252	molecular_function	serine-type endopeptidase activity
E	0005515	molecular_function	protein binding
E	0005576	cellular_component	extracellular region
E	0005615	cellular_component	extracellular space
E	0006508	biological_process	proteolysis
E	0007586	biological_process	digestion
E	0008233	molecular_function	peptidase activity
E	0008236	molecular_function	serine-type peptidase activity
E	0016787	molecular_function	hydrolase activity
E	0046872	molecular_function	metal ion binding
E	0097180	cellular_component	serine protease inhibitor complex
E	0097655	molecular_function	serpin family protein binding
F	0004175	molecular_function	endopeptidase activity
F	0004252	molecular_function	serine-type endopeptidase activity
F	0005515	molecular_function	protein binding
F	0005576	cellular_component	extracellular region
F	0005615	cellular_component	extracellular space
F	0006508	biological_process	proteolysis
F	0007586	biological_process	digestion
F	0008233	molecular_function	peptidase activity
F	0008236	molecular_function	serine-type peptidase activity
F	0016787	molecular_function	hydrolase activity
F	0046872	molecular_function	metal ion binding
F	0097180	cellular_component	serine protease inhibitor complex
F	0097655	molecular_function	serpin family protein binding
G	0004175	molecular_function	endopeptidase activity
G	0004252	molecular_function	serine-type endopeptidase activity
G	0005515	molecular_function	protein binding
G	0005576	cellular_component	extracellular region
G	0005615	cellular_component	extracellular space
G	0006508	biological_process	proteolysis
G	0007586	biological_process	digestion
G	0008233	molecular_function	peptidase activity
G	0008236	molecular_function	serine-type peptidase activity
G	0016787	molecular_function	hydrolase activity
G	0046872	molecular_function	metal ion binding
G	0097180	cellular_component	serine protease inhibitor complex
G	0097655	molecular_function	serpin family protein binding
H	0004175	molecular_function	endopeptidase activity
H	0004252	molecular_function	serine-type endopeptidase activity
H	0005515	molecular_function	protein binding
H	0005576	cellular_component	extracellular region
H	0005615	cellular_component	extracellular space
H	0006508	biological_process	proteolysis
H	0007586	biological_process	digestion
H	0008233	molecular_function	peptidase activity
H	0008236	molecular_function	serine-type peptidase activity
H	0016787	molecular_function	hydrolase activity
H	0046872	molecular_function	metal ion binding
H	0097180	cellular_component	serine protease inhibitor complex
H	0097655	molecular_function	serpin family protein binding
I	0004175	molecular_function	endopeptidase activity
I	0004252	molecular_function	serine-type endopeptidase activity
I	0005515	molecular_function	protein binding
I	0005576	cellular_component	extracellular region
I	0005615	cellular_component	extracellular space
I	0006508	biological_process	proteolysis
I	0007586	biological_process	digestion
I	0008233	molecular_function	peptidase activity
I	0008236	molecular_function	serine-type peptidase activity
I	0016787	molecular_function	hydrolase activity
I	0046872	molecular_function	metal ion binding
I	0097180	cellular_component	serine protease inhibitor complex
I	0097655	molecular_function	serpin family protein binding
J	0004175	molecular_function	endopeptidase activity
J	0004252	molecular_function	serine-type endopeptidase activity
J	0005515	molecular_function	protein binding
J	0005576	cellular_component	extracellular region
J	0005615	cellular_component	extracellular space
J	0006508	biological_process	proteolysis
J	0007586	biological_process	digestion
J	0008233	molecular_function	peptidase activity
J	0008236	molecular_function	serine-type peptidase activity
J	0016787	molecular_function	hydrolase activity
J	0046872	molecular_function	metal ion binding
J	0097180	cellular_component	serine protease inhibitor complex
J	0097655	molecular_function	serpin family protein binding
K	0004175	molecular_function	endopeptidase activity
K	0004252	molecular_function	serine-type endopeptidase activity
K	0005515	molecular_function	protein binding
K	0005576	cellular_component	extracellular region
K	0005615	cellular_component	extracellular space
K	0006508	biological_process	proteolysis
K	0007586	biological_process	digestion
K	0008233	molecular_function	peptidase activity
K	0008236	molecular_function	serine-type peptidase activity
K	0016787	molecular_function	hydrolase activity
K	0046872	molecular_function	metal ion binding
K	0097180	cellular_component	serine protease inhibitor complex
K	0097655	molecular_function	serpin family protein binding
L	0004175	molecular_function	endopeptidase activity
L	0004252	molecular_function	serine-type endopeptidase activity
L	0005515	molecular_function	protein binding
L	0005576	cellular_component	extracellular region
L	0005615	cellular_component	extracellular space
L	0006508	biological_process	proteolysis
L	0007586	biological_process	digestion
L	0008233	molecular_function	peptidase activity
L	0008236	molecular_function	serine-type peptidase activity
L	0016787	molecular_function	hydrolase activity
L	0046872	molecular_function	metal ion binding
L	0097180	cellular_component	serine protease inhibitor complex
L	0097655	molecular_function	serpin family protein binding
M	0004175	molecular_function	endopeptidase activity
M	0004252	molecular_function	serine-type endopeptidase activity
M	0005515	molecular_function	protein binding
M	0005576	cellular_component	extracellular region
M	0005615	cellular_component	extracellular space
M	0006508	biological_process	proteolysis
M	0007586	biological_process	digestion
M	0008233	molecular_function	peptidase activity
M	0008236	molecular_function	serine-type peptidase activity
M	0016787	molecular_function	hydrolase activity
M	0046872	molecular_function	metal ion binding
M	0097180	cellular_component	serine protease inhibitor complex
M	0097655	molecular_function	serpin family protein binding
N	0004175	molecular_function	endopeptidase activity
N	0004252	molecular_function	serine-type endopeptidase activity
N	0005515	molecular_function	protein binding
N	0005576	cellular_component	extracellular region
N	0005615	cellular_component	extracellular space
N	0006508	biological_process	proteolysis
N	0007586	biological_process	digestion
N	0008233	molecular_function	peptidase activity
N	0008236	molecular_function	serine-type peptidase activity
N	0016787	molecular_function	hydrolase activity
N	0046872	molecular_function	metal ion binding
N	0097180	cellular_component	serine protease inhibitor complex
N	0097655	molecular_function	serpin family protein binding
O	0004175	molecular_function	endopeptidase activity
O	0004252	molecular_function	serine-type endopeptidase activity
O	0005515	molecular_function	protein binding
O	0005576	cellular_component	extracellular region
O	0005615	cellular_component	extracellular space
O	0006508	biological_process	proteolysis
O	0007586	biological_process	digestion
O	0008233	molecular_function	peptidase activity
O	0008236	molecular_function	serine-type peptidase activity
O	0016787	molecular_function	hydrolase activity
O	0046872	molecular_function	metal ion binding
O	0097180	cellular_component	serine protease inhibitor complex
O	0097655	molecular_function	serpin family protein binding
P	0004175	molecular_function	endopeptidase activity
P	0004252	molecular_function	serine-type endopeptidase activity
P	0005515	molecular_function	protein binding
P	0005576	cellular_component	extracellular region
P	0005615	cellular_component	extracellular space
P	0006508	biological_process	proteolysis
P	0007586	biological_process	digestion
P	0008233	molecular_function	peptidase activity
P	0008236	molecular_function	serine-type peptidase activity
P	0016787	molecular_function	hydrolase activity
P	0046872	molecular_function	metal ion binding
P	0097180	cellular_component	serine protease inhibitor complex
P	0097655	molecular_function	serpin family protein binding

Functional Information from PDB Data

site_id	AC1
Number of Residues	4
Details	BINDING SITE FOR RESIDUE CA A 480

Chain	Residue
A	GLU70
A	ASN72
A	VAL75
A	GLU80

---

site_id	AC2
Number of Residues	8
Details	BINDING SITE FOR RESIDUE BEN A 481

Chain	Residue
A	GLY219
D	GLU97
D	PHE174
A	ASP189
A	ALA190
A	SER195
A	TRP215
A	GLY216

---

site_id	AC3
Number of Residues	4
Details	BINDING SITE FOR RESIDUE CA B 480

Chain	Residue
B	GLU70
B	ASN72
B	VAL75
B	GLU80

---

site_id	AC4
Number of Residues	9
Details	BINDING SITE FOR RESIDUE BEN B 481

Chain	Residue
B	ASP189
B	ALA190
B	SER195
B	TRP215
B	GLY216
B	GLY219
B	CYS220
B	GLY226
F	PHE174

---

site_id	AC5
Number of Residues	4
Details	BINDING SITE FOR RESIDUE CA C 480

Chain	Residue
C	GLU70
C	ASN72
C	VAL75
C	GLU80

---

site_id	AC6
Number of Residues	9
Details	BINDING SITE FOR RESIDUE BEN C 481

Chain	Residue
C	ASP189
C	ALA190
C	SER195
C	TRP215
C	GLY216
C	GLY219
C	CYS220
C	GLY226
E	PHE174

---

site_id	AC7
Number of Residues	4
Details	BINDING SITE FOR RESIDUE CA D 480

Chain	Residue
D	GLU70
D	ASN72
D	VAL75
D	GLU80

---

site_id	AC8
Number of Residues	8
Details	BINDING SITE FOR RESIDUE BEN D 501

Chain	Residue
A	PHE174
D	ASP189
D	ALA190
D	CYS191
D	SER195
D	TRP215
D	GLY216
D	GLY219

---

site_id	AC9
Number of Residues	4
Details	BINDING SITE FOR RESIDUE CA E 480

Chain	Residue
E	GLU70
E	ASN72
E	VAL75
E	GLU80

---

site_id	BC1
Number of Residues	8
Details	BINDING SITE FOR RESIDUE BEN E 501

Chain	Residue
C	GLU97
C	PHE174
E	ASP189
E	ALA190
E	SER195
E	GLY216
E	GLY219
E	GLY226

---

site_id	BC2
Number of Residues	4
Details	BINDING SITE FOR RESIDUE CA F 480

Chain	Residue
F	GLU70
F	ASN72
F	VAL75
F	GLU80

---

site_id	BC3
Number of Residues	9
Details	BINDING SITE FOR RESIDUE BEN F 501

Chain	Residue
B	PHE174
F	ASP189
F	ALA190
F	CYS191
F	SER195
F	GLY216
F	GLY219
F	CYS220
F	GLY226

---

site_id	BC4
Number of Residues	4
Details	BINDING SITE FOR RESIDUE CA G 480

Chain	Residue
G	GLU70
G	ASN72
G	VAL75
G	GLU80

---

site_id	BC5
Number of Residues	10
Details	BINDING SITE FOR RESIDUE BEN G 501

Chain	Residue
G	ASP189
G	ALA190
G	GLN192
G	SER195
G	TRP215
G	GLY216
G	GLY219
G	CYS220
G	GLY226
H	PHE174

---

site_id	BC6
Number of Residues	5
Details	BINDING SITE FOR RESIDUE CA H 480

Chain	Residue
H	GLU70
H	ASN72
H	VAL75
H	GLU77
H	GLU80

---

site_id	BC7
Number of Residues	1
Details	BINDING SITE FOR RESIDUE CL H 481

Chain	Residue
N	LYS169

---

site_id	BC8
Number of Residues	9
Details	BINDING SITE FOR RESIDUE BEN H 501

Chain	Residue
H	SER214
H	GLY216
H	GLY219
H	CYS220
H	GLY226
G	PHE174
H	ASP189
H	ALA190
H	SER195

---

site_id	BC9
Number of Residues	4
Details	BINDING SITE FOR RESIDUE CA I 480

Chain	Residue
I	GLU70
I	ASN72
I	VAL75
I	GLU80

---

site_id	CC1
Number of Residues	8
Details	BINDING SITE FOR RESIDUE BEN I 501

Chain	Residue
I	ASP189
I	ALA190
I	SER195
I	VAL213
I	GLY216
I	GLY219
I	GLY226
N	PHE174

---

site_id	CC2
Number of Residues	4
Details	BINDING SITE FOR RESIDUE CA J 480

Chain	Residue
J	GLU70
J	ASN72
J	VAL75
J	GLU80

---

site_id	CC3
Number of Residues	9
Details	BINDING SITE FOR RESIDUE BEN J 501

Chain	Residue
J	ASP189
J	ALA190
J	SER195
J	VAL213
J	TRP215
J	GLY216
J	GLY219
J	GLY226
P	PHE174

---

site_id	CC4
Number of Residues	5
Details	BINDING SITE FOR RESIDUE CA K 480

Chain	Residue
K	GLU70
K	ASN72
K	VAL75
K	GLU77
K	GLU80

---

site_id	CC5
Number of Residues	8
Details	BINDING SITE FOR RESIDUE BEN K 501

Chain	Residue
K	ASP189
K	ALA190
K	CYS191
K	SER195
K	TRP215
K	GLY216
K	GLY219
O	PHE174

---

site_id	CC6
Number of Residues	4
Details	BINDING SITE FOR RESIDUE CA L 480

Chain	Residue
L	GLU70
L	ASN72
L	VAL75
L	GLU80

---

site_id	CC7
Number of Residues	10
Details	BINDING SITE FOR RESIDUE BEN L 501

Chain	Residue
L	ASP189
L	ALA190
L	CYS191
L	SER195
L	TRP215
L	GLY216
L	GLY219
L	CYS220
L	GLY226
M	PHE174

---

site_id	CC8
Number of Residues	5
Details	BINDING SITE FOR RESIDUE CA M 480

Chain	Residue
M	GLU70
M	ASN72
M	VAL75
M	GLU77
M	GLU80

---

site_id	CC9
Number of Residues	10
Details	BINDING SITE FOR RESIDUE BEN M 481

Chain	Residue
L	PHE174
M	ASP189
M	ALA190
M	CYS191
M	GLN192
M	TRP215
M	GLY216
M	GLY219
M	CYS220
M	GLY226

---

site_id	DC1
Number of Residues	5
Details	BINDING SITE FOR RESIDUE CA N 480

Chain	Residue
N	GLU70
N	ASN72
N	VAL75
N	VAL76
N	GLU80

---

site_id	DC2
Number of Residues	10
Details	BINDING SITE FOR RESIDUE BEN N 501

Chain	Residue
I	PHE174
N	ASP189
N	ALA190
N	CYS191
N	GLN192
N	SER195
N	TRP215
N	GLY216
N	GLY219
N	GLY226

---

site_id	DC3
Number of Residues	5
Details	BINDING SITE FOR RESIDUE CA O 480

Chain	Residue
O	GLU70
O	ASN72
O	VAL75
O	GLU77
O	GLU80

---

site_id	DC4
Number of Residues	10
Details	BINDING SITE FOR RESIDUE BEN O 501

Chain	Residue
K	PHE174
O	ASP189
O	ALA190
O	CYS191
O	SER195
O	TRP215
O	GLY216
O	GLY219
O	CYS220
O	GLY226

---

site_id	DC5
Number of Residues	5
Details	BINDING SITE FOR RESIDUE CA P 480

Chain	Residue
P	GLU70
P	ASN72
P	VAL75
P	GLU77
P	GLU80

---

site_id	DC6
Number of Residues	9
Details	BINDING SITE FOR RESIDUE BEN P 501

Chain	Residue
J	PHE174
P	ASP189
P	ALA190
P	SER195
P	VAL213
P	TRP215
P	GLY216
P	GLY219
P	GLY226

---

site_id	DC7
Number of Residues	2
Details	BINDING SITE FOR RESIDUE CL P 502

Chain	Residue
P	THR177
P	SER178

---

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
A	VAL53-CYS58

---

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

Chain	Residue	Details
A	ASP189-VAL200

---

Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	3520
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	48
Details	Active site: {"description":"Charge relay system"}

Chain

Residue

Details

---

site_id	SWS_FT_FI3
Number of Residues	112
Details	Binding site: {}

Chain

Residue

Details

---