6QG9

Crystal structure of Ideonella sakaiensis MHETase

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0009279	cellular_component	cell outer membrane
A	0016787	molecular_function	hydrolase activity
A	0042178	biological_process	xenobiotic catabolic process
A	0046872	molecular_function	metal ion binding
A	0052689	molecular_function	carboxylic ester hydrolase activity
B	0009279	cellular_component	cell outer membrane
B	0016787	molecular_function	hydrolase activity
B	0042178	biological_process	xenobiotic catabolic process
B	0046872	molecular_function	metal ion binding
B	0052689	molecular_function	carboxylic ester hydrolase activity
C	0009279	cellular_component	cell outer membrane
C	0016787	molecular_function	hydrolase activity
C	0042178	biological_process	xenobiotic catabolic process
C	0046872	molecular_function	metal ion binding
C	0052689	molecular_function	carboxylic ester hydrolase activity
D	0009279	cellular_component	cell outer membrane
D	0016787	molecular_function	hydrolase activity
D	0042178	biological_process	xenobiotic catabolic process
D	0046872	molecular_function	metal ion binding
D	0052689	molecular_function	carboxylic ester hydrolase activity
E	0009279	cellular_component	cell outer membrane
E	0016787	molecular_function	hydrolase activity
E	0042178	biological_process	xenobiotic catabolic process
E	0046872	molecular_function	metal ion binding
E	0052689	molecular_function	carboxylic ester hydrolase activity
F	0009279	cellular_component	cell outer membrane
F	0016787	molecular_function	hydrolase activity
F	0042178	biological_process	xenobiotic catabolic process
F	0046872	molecular_function	metal ion binding
F	0052689	molecular_function	carboxylic ester hydrolase activity
G	0009279	cellular_component	cell outer membrane
G	0016787	molecular_function	hydrolase activity
G	0042178	biological_process	xenobiotic catabolic process
G	0046872	molecular_function	metal ion binding
G	0052689	molecular_function	carboxylic ester hydrolase activity
H	0009279	cellular_component	cell outer membrane
H	0016787	molecular_function	hydrolase activity
H	0042178	biological_process	xenobiotic catabolic process
H	0046872	molecular_function	metal ion binding
H	0052689	molecular_function	carboxylic ester hydrolase activity
I	0009279	cellular_component	cell outer membrane
I	0016787	molecular_function	hydrolase activity
I	0042178	biological_process	xenobiotic catabolic process
I	0046872	molecular_function	metal ion binding
I	0052689	molecular_function	carboxylic ester hydrolase activity
J	0009279	cellular_component	cell outer membrane
J	0016787	molecular_function	hydrolase activity
J	0042178	biological_process	xenobiotic catabolic process
J	0046872	molecular_function	metal ion binding
J	0052689	molecular_function	carboxylic ester hydrolase activity

Functional Information from PDB Data

site_id	AC1
Number of Residues	8
Details	binding site for residue EDO A 701

Chain	Residue
A	TYR317
A	LEU522
A	CYS577
A	TYR579
A	PRO580
A	GLN581
A	ILE582
A	HOH863

---

site_id	AC2
Number of Residues	5
Details	binding site for residue CA A 702

Chain	Residue
A	ASP307
A	LEU309
A	ASP311
A	ILE313
A	ASP304

---

site_id	AC3
Number of Residues	2
Details	binding site for residue ZN A 703

Chain	Residue
A	GLU93
A	HOH1139

---

site_id	AC4
Number of Residues	2
Details	binding site for residue ZN A 704

Chain	Residue
A	ASP347
F	HOH999

---

site_id	AC5
Number of Residues	6
Details	binding site for residue CA B 701

Chain	Residue
B	ASP304
B	ASP307
B	LEU309
B	ASP311
B	ILE313
B	HOH924

---

site_id	AC6
Number of Residues	4
Details	binding site for residue ZN B 702

Chain	Residue
B	GLU93
B	ARG116
B	HOH1118
B	HOH1199

---

site_id	AC7
Number of Residues	6
Details	binding site for residue CA C 701

Chain	Residue
C	ASP304
C	ASP307
C	LEU309
C	ASP311
C	ILE313
C	HOH840

---

site_id	AC8
Number of Residues	3
Details	binding site for residue ZN C 702

Chain	Residue
C	GLU93
C	HOH1132
C	HOH1156

---

site_id	AC9
Number of Residues	2
Details	binding site for residue ACT D 701

Chain	Residue
D	HIS293
D	HOH1094

---

site_id	AD1
Number of Residues	6
Details	binding site for residue CA D 702

Chain	Residue
D	ASP304
D	ASP307
D	LEU309
D	ASP311
D	ILE313
D	HOH969

---

site_id	AD2
Number of Residues	3
Details	binding site for residue ZN D 703

Chain	Residue
D	ARG76
D	GLU93
D	HOH1127

---

site_id	AD3
Number of Residues	6
Details	binding site for residue CA E 701

Chain	Residue
E	ASP304
E	ASP307
E	LEU309
E	ASP311
E	ILE313
E	HOH842

---

site_id	AD4
Number of Residues	2
Details	binding site for residue ZN E 702

Chain	Residue
E	ASP175
H	HIS293

---

site_id	AD5
Number of Residues	2
Details	binding site for residue ZN E 703

Chain	Residue
E	GLU93
E	ARG116

---

site_id	AD6
Number of Residues	9
Details	binding site for residue ACT F 701

Chain	Residue
F	LEU254
F	ALA257
F	TRP397
F	ARG411
F	SER416
F	HOH934
F	HOH1005
F	HOH1045
F	HOH1078

---

site_id	AD7
Number of Residues	6
Details	binding site for residue CA F 702

Chain	Residue
F	ASP304
F	ASP307
F	LEU309
F	ASP311
F	ILE313
F	HOH824

---

site_id	AD8
Number of Residues	1
Details	binding site for residue ZN F 703

Chain	Residue
F	GLU93

---

site_id	AD9
Number of Residues	6
Details	binding site for residue CA G 701

Chain	Residue
G	ASP304
G	ASP307
G	LEU309
G	ASP311
G	ILE313
G	HOH813

---

site_id	AE1
Number of Residues	3
Details	binding site for residue ZN G 702

Chain	Residue
G	GLU93
G	ARG116
G	HOH1027

---

site_id	AE2
Number of Residues	6
Details	binding site for residue CA H 701

Chain	Residue
H	ASP304
H	ASP307
H	LEU309
H	ASP311
H	ILE313
H	HOH866

---

site_id	AE3
Number of Residues	2
Details	binding site for residue ZN H 702

Chain	Residue
H	GLU93
H	HOH1027

---

site_id	AE4
Number of Residues	5
Details	binding site for residue CA I 701

Chain	Residue
I	ASP304
I	ASP307
I	LEU309
I	ASP311
I	ILE313

---

site_id	AE5
Number of Residues	3
Details	binding site for residue ZN I 702

Chain	Residue
B	HOH1077
I	ASP175
I	HOH990

---

site_id	AE6
Number of Residues	5
Details	binding site for residue CA J 701

Chain	Residue
J	ASP307
J	LEU309
J	ASP311
J	ILE313
J	ASP304

---

Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	10
Details	Active site: {"description":"Acyl-ester intermediate","evidences":[{"source":"PubMed","id":"30979881","evidenceCode":"ECO:0000305"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI2
Number of Residues	20
Details	Active site: {"description":"Charge relay system","evidences":[{"source":"PubMed","id":"30979881","evidenceCode":"ECO:0000305"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI3
Number of Residues	50
Details	Binding site: {"evidences":[{"source":"PubMed","id":"30979881","evidenceCode":"ECO:0000305"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI4
Number of Residues	50
Details	Binding site: {"evidences":[{"source":"PubMed","id":"30979881","evidenceCode":"ECO:0000269"}]}

Chain

Residue

Details

---