2X1D

The crystal structure of mature acyl coenzyme A:isopenicillin N acyltransferase from Penicillium chrysogenum

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0005777	cellular_component	peroxisome
A	0005782	cellular_component	peroxisomal matrix
A	0016746	molecular_function	acyltransferase activity
A	0017000	biological_process	antibiotic biosynthetic process
A	0042318	biological_process	penicillin biosynthetic process
A	0050640	molecular_function	isopenicillin-N N-acyltransferase activity
A	0102920	molecular_function	acyl coenzyme A
B	0005777	cellular_component	peroxisome
B	0005782	cellular_component	peroxisomal matrix
B	0016746	molecular_function	acyltransferase activity
B	0017000	biological_process	antibiotic biosynthetic process
B	0042318	biological_process	penicillin biosynthetic process
B	0050640	molecular_function	isopenicillin-N N-acyltransferase activity
B	0102920	molecular_function	acyl coenzyme A
C	0005777	cellular_component	peroxisome
C	0005782	cellular_component	peroxisomal matrix
C	0016746	molecular_function	acyltransferase activity
C	0017000	biological_process	antibiotic biosynthetic process
C	0042318	biological_process	penicillin biosynthetic process
C	0050640	molecular_function	isopenicillin-N N-acyltransferase activity
C	0102920	molecular_function	acyl coenzyme A
D	0005777	cellular_component	peroxisome
D	0005782	cellular_component	peroxisomal matrix
D	0016746	molecular_function	acyltransferase activity
D	0017000	biological_process	antibiotic biosynthetic process
D	0042318	biological_process	penicillin biosynthetic process
D	0050640	molecular_function	isopenicillin-N N-acyltransferase activity
D	0102920	molecular_function	acyl coenzyme A

Functional Information from PDB Data

site_id	AC1
Number of Residues	9
Details	BINDING SITE FOR RESIDUE PO4 D 1356

Chain	Residue
D	ARG132
D	LYS144
D	VAL341
D	MET342
D	ARG343
D	PO41357
D	HOH2210
D	HOH2211
D	HOH2218

---

site_id	AC2
Number of Residues	10
Details	BINDING SITE FOR RESIDUE PO4 A 1356

Chain	Residue
A	ARG132
A	LYS144
A	VAL341
A	MET342
A	ARG343
A	GOL1357
A	HOH2192
A	HOH2200
A	HOH2201
D	HOH2208

---

site_id	AC3
Number of Residues	8
Details	BINDING SITE FOR RESIDUE PO4 B 1357

Chain	Residue
B	ARG132
B	LYS144
B	VAL341
B	MET342
B	ARG343
B	ARG343
B	HOH2259
B	HOH2260

---

site_id	AC4
Number of Residues	2
Details	BINDING SITE FOR RESIDUE PO4 D 1357

Chain	Residue
D	HIS3
D	PO41356

---

site_id	AC5
Number of Residues	9
Details	BINDING SITE FOR RESIDUE GOL A 1357

Chain	Residue
A	HIS3
A	THR134
A	ARG136
A	LYS144
A	ASP345
A	ASP348
A	PO41356
A	HOH2201
A	HOH2202

---

site_id	AC6
Number of Residues	6
Details	BINDING SITE FOR RESIDUE ACT C 1357

Chain	Residue
C	ARG175
C	THR177
C	HOH2225
C	HOH2226
D	LEU174
D	ARG175

---

site_id	AC7
Number of Residues	6
Details	BINDING SITE FOR RESIDUE ACT D 1358

Chain	Residue
C	LEU174
C	ARG175
D	ARG175
D	THR177
D	HOH2219
D	HOH2220

---

site_id	AC8
Number of Residues	5
Details	BINDING SITE FOR RESIDUE ACT B 1358

Chain	Residue
A	ARG61
B	GLY253
B	ASN255
B	GLU256
B	HOH2170

---

site_id	AC9
Number of Residues	5
Details	BINDING SITE FOR RESIDUE D1D D 1359

Chain	Residue
D	ARG37
D	ASP44
D	LEU51
D	HOH2032
D	HOH2221

---

site_id	BC1
Number of Residues	2
Details	BINDING SITE FOR RESIDUE CL C 1358

Chain	Residue
C	GLU220
C	PHE222

---

site_id	BC2
Number of Residues	3
Details	BINDING SITE FOR RESIDUE CL B 1360

Chain	Residue
B	PHE340
B	VAL341
B	HOH2246

---

Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	8
Details	BINDING: BINDING => ECO:0000269|PubMed:20223213, ECO:0007744|PDB:2X1E

Chain	Residue	Details
A	ASP121
A	ARG310
B	ASP121
B	ARG310
C	ASP121
C	ARG310
D	ASP121
D	ARG310

---