3ZWW

Crystal structure of ADP-ribosyl cyclase complexed with ara-2'F-ADP- ribose at 2.3 angstrom

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0003953	molecular_function	NAD+ nucleosidase activity
A	0005886	cellular_component	plasma membrane
A	0007338	biological_process	single fertilization
A	0016020	cellular_component	membrane
A	0016740	molecular_function	transferase activity
A	0016787	molecular_function	hydrolase activity
A	0016849	molecular_function	phosphorus-oxygen lyase activity
A	0030890	biological_process	positive regulation of B cell proliferation
A	0031410	cellular_component	cytoplasmic vesicle
A	0061809	molecular_function	NAD+ nucleotidase, cyclic ADP-ribose generating
B	0003953	molecular_function	NAD+ nucleosidase activity
B	0005886	cellular_component	plasma membrane
B	0007338	biological_process	single fertilization
B	0016020	cellular_component	membrane
B	0016740	molecular_function	transferase activity
B	0016787	molecular_function	hydrolase activity
B	0016849	molecular_function	phosphorus-oxygen lyase activity
B	0030890	biological_process	positive regulation of B cell proliferation
B	0031410	cellular_component	cytoplasmic vesicle
B	0061809	molecular_function	NAD+ nucleotidase, cyclic ADP-ribose generating
C	0003953	molecular_function	NAD+ nucleosidase activity
C	0005886	cellular_component	plasma membrane
C	0007338	biological_process	single fertilization
C	0016020	cellular_component	membrane
C	0016740	molecular_function	transferase activity
C	0016787	molecular_function	hydrolase activity
C	0016849	molecular_function	phosphorus-oxygen lyase activity
C	0030890	biological_process	positive regulation of B cell proliferation
C	0031410	cellular_component	cytoplasmic vesicle
C	0061809	molecular_function	NAD+ nucleotidase, cyclic ADP-ribose generating
D	0003953	molecular_function	NAD+ nucleosidase activity
D	0005886	cellular_component	plasma membrane
D	0007338	biological_process	single fertilization
D	0016020	cellular_component	membrane
D	0016740	molecular_function	transferase activity
D	0016787	molecular_function	hydrolase activity
D	0016849	molecular_function	phosphorus-oxygen lyase activity
D	0030890	biological_process	positive regulation of B cell proliferation
D	0031410	cellular_component	cytoplasmic vesicle
D	0061809	molecular_function	NAD+ nucleotidase, cyclic ADP-ribose generating
E	0003953	molecular_function	NAD+ nucleosidase activity
E	0005886	cellular_component	plasma membrane
E	0007338	biological_process	single fertilization
E	0016020	cellular_component	membrane
E	0016740	molecular_function	transferase activity
E	0016787	molecular_function	hydrolase activity
E	0016849	molecular_function	phosphorus-oxygen lyase activity
E	0030890	biological_process	positive regulation of B cell proliferation
E	0031410	cellular_component	cytoplasmic vesicle
E	0061809	molecular_function	NAD+ nucleotidase, cyclic ADP-ribose generating
F	0003953	molecular_function	NAD+ nucleosidase activity
F	0005886	cellular_component	plasma membrane
F	0007338	biological_process	single fertilization
F	0016020	cellular_component	membrane
F	0016740	molecular_function	transferase activity
F	0016787	molecular_function	hydrolase activity
F	0016849	molecular_function	phosphorus-oxygen lyase activity
F	0030890	biological_process	positive regulation of B cell proliferation
F	0031410	cellular_component	cytoplasmic vesicle
F	0061809	molecular_function	NAD+ nucleotidase, cyclic ADP-ribose generating
G	0003953	molecular_function	NAD+ nucleosidase activity
G	0005886	cellular_component	plasma membrane
G	0007338	biological_process	single fertilization
G	0016020	cellular_component	membrane
G	0016740	molecular_function	transferase activity
G	0016787	molecular_function	hydrolase activity
G	0016849	molecular_function	phosphorus-oxygen lyase activity
G	0030890	biological_process	positive regulation of B cell proliferation
G	0031410	cellular_component	cytoplasmic vesicle
G	0061809	molecular_function	NAD+ nucleotidase, cyclic ADP-ribose generating
H	0003953	molecular_function	NAD+ nucleosidase activity
H	0005886	cellular_component	plasma membrane
H	0007338	biological_process	single fertilization
H	0016020	cellular_component	membrane
H	0016740	molecular_function	transferase activity
H	0016787	molecular_function	hydrolase activity
H	0016849	molecular_function	phosphorus-oxygen lyase activity
H	0030890	biological_process	positive regulation of B cell proliferation
H	0031410	cellular_component	cytoplasmic vesicle
H	0061809	molecular_function	NAD+ nucleotidase, cyclic ADP-ribose generating

Functional Information from PDB Data

site_id	AC1
Number of Residues	15
Details	BINDING SITE FOR RESIDUE AVU A 301

Chain	Residue
A	PHE76
A	ARG170
A	SER173
A	PHE174
A	PHE175
A	GLU179
A	HOH2026
A	TRP77
A	SER78
A	GLY79
A	LEU97
A	GLU98
A	ASN107
A	SER108
A	SER144

---

site_id	AC2
Number of Residues	10
Details	BINDING SITE FOR RESIDUE AVU B 301

Chain	Residue
B	PHE76
B	TRP77
B	SER78
B	GLY79
B	TYR81
B	LEU97
B	SER144
B	PHE174
B	PHE175
B	GLU179

---

site_id	AC3
Number of Residues	13
Details	BINDING SITE FOR RESIDUE AVU C 301

Chain	Residue
C	PHE76
C	TRP77
C	SER78
C	GLY79
C	TYR81
C	LEU97
C	ASN107
C	SER144
C	PHE174
C	PHE175
C	GLU179
C	HOH2061
C	HOH2062

---

site_id	AC4
Number of Residues	14
Details	BINDING SITE FOR RESIDUE AVU D 301

Chain	Residue
D	PHE76
D	TRP77
D	SER78
D	GLY79
D	LEU97
D	GLU98
D	TRP140
D	SER144
D	ARG170
D	SER173
D	PHE174
D	PHE175
D	GLU179
D	HOH2031

---

site_id	AC5
Number of Residues	11
Details	BINDING SITE FOR RESIDUE AVU E 301

Chain	Residue
E	PHE76
E	TRP77
E	SER78
E	GLY79
E	TYR81
E	SER144
E	ARG170
E	SER173
E	PHE174
E	PHE175
E	GLU179

---

site_id	AC6
Number of Residues	13
Details	BINDING SITE FOR RESIDUE AVU F 301

Chain	Residue
F	PHE76
F	TRP77
F	SER78
F	GLY79
F	LEU97
F	GLU98
F	ASN107
F	TRP140
F	SER144
F	ARG170
F	PHE174
F	PHE175
F	GLU179

---

site_id	AC7
Number of Residues	12
Details	BINDING SITE FOR RESIDUE AVU G 301

Chain	Residue
G	PHE76
G	TRP77
G	SER78
G	GLY79
G	TYR81
G	LEU97
G	SER144
G	ARG170
G	SER173
G	PHE174
G	PHE175
G	GLU179

---

site_id	AC8
Number of Residues	14
Details	BINDING SITE FOR RESIDUE AVU H 301

Chain	Residue
H	PHE174
H	PHE175
H	GLU179
H	PHE76
H	TRP77
H	SER78
H	GLY79
H	LEU97
H	GLU98
H	ASN107
H	TRP140
H	SER144
H	ARG170
H	SER173

---

Catalytic Information from CSA

site_id	MCSA1
Number of Residues	3
Details	M-CSA 607

Chain	Residue	Details
A	GLU98	electrostatic stabiliser
A	PHE174	hydrophobic interaction
A	GLU179	covalent catalysis, covalently attached, nucleophile

---

site_id	MCSA2
Number of Residues	3
Details	M-CSA 607

Chain	Residue	Details
B	GLU98	electrostatic stabiliser
B	PHE174	hydrophobic interaction
B	GLU179	covalent catalysis, covalently attached, nucleophile

---

site_id	MCSA3
Number of Residues	3
Details	M-CSA 607

Chain	Residue	Details
C	GLU98	electrostatic stabiliser
C	PHE174	hydrophobic interaction
C	GLU179	covalent catalysis, covalently attached, nucleophile

---

site_id	MCSA4
Number of Residues	3
Details	M-CSA 607

Chain	Residue	Details
D	GLU98	electrostatic stabiliser
D	PHE174	hydrophobic interaction
D	GLU179	covalent catalysis, covalently attached, nucleophile

---

site_id	MCSA5
Number of Residues	3
Details	M-CSA 607

Chain	Residue	Details
E	GLU98	electrostatic stabiliser
E	PHE174	hydrophobic interaction
E	GLU179	covalent catalysis, covalently attached, nucleophile

---

site_id	MCSA6
Number of Residues	3
Details	M-CSA 607

Chain	Residue	Details
F	GLU98	electrostatic stabiliser
F	PHE174	hydrophobic interaction
F	GLU179	covalent catalysis, covalently attached, nucleophile

---

site_id	MCSA7
Number of Residues	3
Details	M-CSA 607

Chain	Residue	Details
G	GLU98	electrostatic stabiliser
G	PHE174	hydrophobic interaction
G	GLU179	covalent catalysis, covalently attached, nucleophile

---

site_id	MCSA8
Number of Residues	3
Details	M-CSA 607

Chain	Residue	Details
H	GLU98	electrostatic stabiliser
H	PHE174	hydrophobic interaction
H	GLU179	covalent catalysis, covalently attached, nucleophile

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