3GZJ

Crystal Structure of Polyneuridine Aldehyde Esterase Complexed with 16-epi-Vellosimine

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0009694	biological_process	jasmonic acid metabolic process
A	0009696	biological_process	salicylic acid metabolic process
A	0009820	biological_process	alkaloid metabolic process
A	0016787	molecular_function	hydrolase activity
A	0035834	biological_process	indole alkaloid metabolic process
A	0050529	molecular_function	polyneuridine-aldehyde esterase activity
A	0052689	molecular_function	carboxylic ester hydrolase activity
A	0080030	molecular_function	methyl indole-3-acetate esterase activity
A	0080031	molecular_function	methyl salicylate esterase activity
A	0080032	molecular_function	methyl jasmonate esterase activity
B	0009694	biological_process	jasmonic acid metabolic process
B	0009696	biological_process	salicylic acid metabolic process
B	0009820	biological_process	alkaloid metabolic process
B	0016787	molecular_function	hydrolase activity
B	0035834	biological_process	indole alkaloid metabolic process
B	0050529	molecular_function	polyneuridine-aldehyde esterase activity
B	0052689	molecular_function	carboxylic ester hydrolase activity
B	0080030	molecular_function	methyl indole-3-acetate esterase activity
B	0080031	molecular_function	methyl salicylate esterase activity
B	0080032	molecular_function	methyl jasmonate esterase activity
C	0009694	biological_process	jasmonic acid metabolic process
C	0009696	biological_process	salicylic acid metabolic process
C	0009820	biological_process	alkaloid metabolic process
C	0016787	molecular_function	hydrolase activity
C	0035834	biological_process	indole alkaloid metabolic process
C	0050529	molecular_function	polyneuridine-aldehyde esterase activity
C	0052689	molecular_function	carboxylic ester hydrolase activity
C	0080030	molecular_function	methyl indole-3-acetate esterase activity
C	0080031	molecular_function	methyl salicylate esterase activity
C	0080032	molecular_function	methyl jasmonate esterase activity
D	0009694	biological_process	jasmonic acid metabolic process
D	0009696	biological_process	salicylic acid metabolic process
D	0009820	biological_process	alkaloid metabolic process
D	0016787	molecular_function	hydrolase activity
D	0035834	biological_process	indole alkaloid metabolic process
D	0050529	molecular_function	polyneuridine-aldehyde esterase activity
D	0052689	molecular_function	carboxylic ester hydrolase activity
D	0080030	molecular_function	methyl indole-3-acetate esterase activity
D	0080031	molecular_function	methyl salicylate esterase activity
D	0080032	molecular_function	methyl jasmonate esterase activity
E	0009694	biological_process	jasmonic acid metabolic process
E	0009696	biological_process	salicylic acid metabolic process
E	0009820	biological_process	alkaloid metabolic process
E	0016787	molecular_function	hydrolase activity
E	0035834	biological_process	indole alkaloid metabolic process
E	0050529	molecular_function	polyneuridine-aldehyde esterase activity
E	0052689	molecular_function	carboxylic ester hydrolase activity
E	0080030	molecular_function	methyl indole-3-acetate esterase activity
E	0080031	molecular_function	methyl salicylate esterase activity
E	0080032	molecular_function	methyl jasmonate esterase activity

Functional Information from PDB Data

site_id	AC1
Number of Residues	10
Details	BINDING SITE FOR RESIDUE EVS A 1000

Chain	Residue
A	HOH3
A	HOH270
A	GLY19
A	SER87
A	PHE88
A	MET113
A	PRO124
A	TYR128
A	MET155
A	LEU187

---

site_id	AC2
Number of Residues	10
Details	BINDING SITE FOR RESIDUE EVS B 1000

Chain	Residue
B	GLY19
B	SER87
B	PHE88
B	MET113
B	PRO124
B	PHE125
B	TYR128
B	MET137
B	LEU187
B	HOH290

---

site_id	AC3
Number of Residues	12
Details	BINDING SITE FOR RESIDUE EVS C 1000

Chain	Residue
C	GLY19
C	SER87
C	PHE88
C	MET113
C	PHE125
C	TYR128
C	MET155
C	LEU157
C	LEU187
C	HOH270
C	HOH289
D	HOH301

---

site_id	AC4
Number of Residues	11
Details	BINDING SITE FOR RESIDUE EVS D 1000

Chain	Residue
D	GLY19
D	SER87
D	PHE88
D	MET113
D	PRO124
D	PHE125
D	TYR128
D	MET137
D	LEU157
D	HOH270
D	HOH282

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Functional Information from PROSITE/UniProt

site_id	PS00120
Number of Residues	10
Details	LIPASE_SER Lipases, serine active site. VVLLGHSFGG

Chain	Residue	Details
A	VAL81-GLY90

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Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	15
Details	ACT_SITE: ACT_SITE => ECO:0000269|PubMed:12071952

Chain	Residue	Details
A	SER87
D	SER87
D	ASP216
D	ALA244
E	SER87
E	ASP216
E	ALA244
A	ASP216
A	ALA244
B	SER87
B	ASP216
B	ALA244
C	SER87
C	ASP216
C	ALA244

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site_id	SWS_FT_FI2
Number of Residues	5
Details	BINDING: covalent => ECO:0000269|PubMed:19496101, ECO:0007744|PDB:3GZJ

Chain	Residue	Details
A	SER87
B	SER87
C	SER87
D	SER87
E	SER87

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