3UF9

Crystal structure of SsoPox in complex with the phosphotriester fensulfothion

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0004063	molecular_function	aryldialkylphosphatase activity
A	0008270	molecular_function	zinc ion binding
A	0009056	biological_process	catabolic process
A	0016787	molecular_function	hydrolase activity
A	0016788	molecular_function	hydrolase activity, acting on ester bonds
A	0046872	molecular_function	metal ion binding
B	0004063	molecular_function	aryldialkylphosphatase activity
B	0008270	molecular_function	zinc ion binding
B	0009056	biological_process	catabolic process
B	0016787	molecular_function	hydrolase activity
B	0016788	molecular_function	hydrolase activity, acting on ester bonds
B	0046872	molecular_function	metal ion binding
C	0004063	molecular_function	aryldialkylphosphatase activity
C	0008270	molecular_function	zinc ion binding
C	0009056	biological_process	catabolic process
C	0016787	molecular_function	hydrolase activity
C	0016788	molecular_function	hydrolase activity, acting on ester bonds
C	0046872	molecular_function	metal ion binding
D	0004063	molecular_function	aryldialkylphosphatase activity
D	0008270	molecular_function	zinc ion binding
D	0009056	biological_process	catabolic process
D	0016787	molecular_function	hydrolase activity
D	0016788	molecular_function	hydrolase activity, acting on ester bonds
D	0046872	molecular_function	metal ion binding

Functional Information from PDB Data

site_id	AC1
Number of Residues	7
Details	BINDING SITE FOR RESIDUE FE2 A 315

Chain	Residue
A	HIS22
A	HIS24
A	KCX137
A	ASP256
A	CO316
A	FST317
A	HOH359

---

site_id	AC2
Number of Residues	7
Details	BINDING SITE FOR RESIDUE CO A 316

Chain	Residue
A	HIS199
A	ARG223
A	FE2315
A	HOH359
A	HOH362
A	KCX137
A	HIS170

---

site_id	AC3
Number of Residues	10
Details	BINDING SITE FOR RESIDUE FST A 317

Chain	Residue
A	HIS24
A	KCX137
A	LEU226
A	ASP256
A	ILE261
A	TRP263
A	THR265
A	ALA266
A	FE2315
A	HOH359

---

site_id	AC4
Number of Residues	4
Details	BINDING SITE FOR RESIDUE GOL A 318

Chain	Residue
A	ASN160
A	GLY189
A	VAL190
A	ASP191

---

site_id	AC5
Number of Residues	4
Details	BINDING SITE FOR RESIDUE GOL A 319

Chain	Residue
A	GLN58
A	PHE59
B	PHE59
B	PHE284

---

site_id	AC6
Number of Residues	8
Details	BINDING SITE FOR RESIDUE FE2 B 315

Chain	Residue
B	HIS22
B	HIS24
B	KCX137
B	ASP256
B	CO316
B	FST317
B	HOH363
B	HOH367

---

site_id	AC7
Number of Residues	6
Details	BINDING SITE FOR RESIDUE CO B 316

Chain	Residue
B	KCX137
B	HIS170
B	HIS199
B	FE2315
B	HOH363
B	HOH367

---

site_id	AC8
Number of Residues	12
Details	BINDING SITE FOR RESIDUE FST B 317

Chain	Residue
B	HIS24
B	KCX137
B	ARG223
B	LEU226
B	LEU228
B	PHE229
B	ASP256
B	ILE261
B	ALA266
B	FE2315
B	HOH363
B	HOH367

---

site_id	AC9
Number of Residues	6
Details	BINDING SITE FOR RESIDUE GOL B 318

Chain	Residue
B	ALA173
B	HIS174
B	ASN175
B	ASN176
B	ASN205
B	TYR208

---

site_id	BC1
Number of Residues	7
Details	BINDING SITE FOR RESIDUE FE2 C 315

Chain	Residue
C	HIS22
C	HIS24
C	KCX137
C	ASP256
C	CO316
C	FST317
C	HOH347

---

site_id	BC2
Number of Residues	6
Details	BINDING SITE FOR RESIDUE CO C 316

Chain	Residue
C	KCX137
C	HIS170
C	HIS199
C	FE2315
C	HOH347
C	HOH348

---

site_id	BC3
Number of Residues	12
Details	BINDING SITE FOR RESIDUE FST C 317

Chain	Residue
C	HIS24
C	ARG223
C	LEU226
C	LEU228
C	PHE229
C	ASP256
C	CYS258
C	TRP263
C	THR265
C	ALA266
C	FE2315
C	HOH348

---

site_id	BC4
Number of Residues	7
Details	BINDING SITE FOR RESIDUE FE2 D 315

Chain	Residue
D	HIS22
D	HIS24
D	KCX137
D	ASP256
D	CO316
D	FST317
D	HOH349

---

site_id	BC5
Number of Residues	6
Details	BINDING SITE FOR RESIDUE CO D 316

Chain	Residue
D	FE2315
D	HOH345
D	HOH349
D	KCX137
D	HIS170
D	HIS199

---

site_id	BC6
Number of Residues	9
Details	BINDING SITE FOR RESIDUE FST D 317

Chain	Residue
D	HIS24
D	ARG223
D	PHE229
D	ASP256
D	CYS258
D	TRP263
D	THR265
D	FE2315
D	HOH331

---

Functional Information from PROSITE/UniProt

site_id	PS01322
Number of Residues	9
Details	PHOSPHOTRIESTERASE_1 Phosphotriesterase family signature 1. GfTLiHEHL

Chain	Residue	Details
A	GLY17-LEU25

---

Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	20
Details	Binding site: {"evidences":[{"source":"PubMed","id":"18486146","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"2VC5","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"2VC7","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3UF9","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"4KER","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"4KES","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"4KET","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"4KEU","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"4KEV","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"4KEZ","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"4KF1","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI2
Number of Residues	4
Details	Binding site: {"description":"via carbamate group","evidences":[{"source":"PubMed","id":"18486146","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"2VC5","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"2VC7","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3UF9","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"4KER","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"4KES","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"4KET","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"4KEU","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"4KEV","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"4KEZ","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"4KF1","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI3
Number of Residues	4
Details	Modified residue: {"description":"N6-carboxylysine","evidences":[{"source":"PROSITE-ProRule","id":"PRU00679","evidenceCode":"ECO:0000255"},{"source":"PubMed","id":"18486146","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"2VC5","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"2VC7","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3UF9","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"4KER","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"4KES","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"4KET","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"4KEU","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"4KEV","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"4KEZ","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"4KF1","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

---