4QIF

Crystal Structure of PduA with edge mutation K26A and pore mutation S40H

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0031469	cellular_component	bacterial microcompartment
A	0031472	cellular_component	propanediol degradation polyhedral organelle
A	0051144	biological_process	1,2-propanediol catabolic process
B	0031469	cellular_component	bacterial microcompartment
B	0031472	cellular_component	propanediol degradation polyhedral organelle
B	0051144	biological_process	1,2-propanediol catabolic process
C	0031469	cellular_component	bacterial microcompartment
C	0031472	cellular_component	propanediol degradation polyhedral organelle
C	0051144	biological_process	1,2-propanediol catabolic process
D	0031469	cellular_component	bacterial microcompartment
D	0031472	cellular_component	propanediol degradation polyhedral organelle
D	0051144	biological_process	1,2-propanediol catabolic process
E	0031469	cellular_component	bacterial microcompartment
E	0031472	cellular_component	propanediol degradation polyhedral organelle
E	0051144	biological_process	1,2-propanediol catabolic process
F	0031469	cellular_component	bacterial microcompartment
F	0031472	cellular_component	propanediol degradation polyhedral organelle
F	0051144	biological_process	1,2-propanediol catabolic process
G	0031469	cellular_component	bacterial microcompartment
G	0031472	cellular_component	propanediol degradation polyhedral organelle
G	0051144	biological_process	1,2-propanediol catabolic process
H	0031469	cellular_component	bacterial microcompartment
H	0031472	cellular_component	propanediol degradation polyhedral organelle
H	0051144	biological_process	1,2-propanediol catabolic process
I	0031469	cellular_component	bacterial microcompartment
I	0031472	cellular_component	propanediol degradation polyhedral organelle
I	0051144	biological_process	1,2-propanediol catabolic process

Functional Information from PDB Data

site_id	AC1
Number of Residues	5
Details	BINDING SITE FOR RESIDUE PGO A 101

Chain	Residue
A	ILE38
A	HOH240
C	SO4101
F	LYS37
F	GLY39

---

site_id	AC2
Number of Residues	5
Details	BINDING SITE FOR RESIDUE SO4 A 102

Chain	Residue
A	GLU85
A	ARG48
A	HIS81
A	ASP83
A	VAL84

---

site_id	AC3
Number of Residues	7
Details	BINDING SITE FOR RESIDUE SO4 A 103

Chain	Residue
A	HIS40
B	HIS40
C	HIS40
D	HIS40
D	TAR101
E	HIS40
F	HIS40

---

site_id	AC4
Number of Residues	7
Details	BINDING SITE FOR RESIDUE SO4 A 104

Chain	Residue
A	LYS12
A	HIS40
A	LYS72
A	HOH236
F	LYS12
F	GOL102
F	GOL103

---

site_id	AC5
Number of Residues	4
Details	BINDING SITE FOR RESIDUE SO4 A 105

Chain	Residue
A	GLU36
A	PRO89
F	TYR35
F	LYS37

---

site_id	AC6
Number of Residues	2
Details	BINDING SITE FOR RESIDUE K B 101

Chain	Residue
E	HOH209
I	HOH220

---

site_id	AC7
Number of Residues	4
Details	BINDING SITE FOR RESIDUE GOL B 102

Chain	Residue
B	LYS12
B	HIS40
B	LYS72
D	LYS12

---

site_id	AC8
Number of Residues	4
Details	BINDING SITE FOR RESIDUE SO4 B 103

Chain	Residue
B	LYS37
B	HOH218
B	HOH239
F	LYS37

---

site_id	AC9
Number of Residues	5
Details	BINDING SITE FOR RESIDUE SO4 C 101

Chain	Residue
A	PGO101
A	HOH240
B	ILE38
C	LYS37
D	GLY39

---

site_id	BC1
Number of Residues	3
Details	BINDING SITE FOR RESIDUE SO4 B 104

Chain	Residue
B	MET31
B	LEU32
F	THR82

---

site_id	BC2
Number of Residues	6
Details	BINDING SITE FOR RESIDUE PGO C 102

Chain	Residue
A	HOH240
C	LYS37
C	GLY39
D	ILE38
E	SO4103
F	SO4101

---

site_id	BC3
Number of Residues	17
Details	BINDING SITE FOR RESIDUE TAR D 101

Chain	Residue
A	GLY39
A	HIS40
A	SO4103
A	HOH207
A	HOH240
B	GLY39
B	HIS40
C	GLY39
C	HIS40
D	GLY39
D	HIS40
D	HOH205
D	HOH232
E	GLY39
E	HIS40
F	GLY39
F	HIS40

---

site_id	BC4
Number of Residues	5
Details	BINDING SITE FOR RESIDUE TAR D 102

Chain	Residue
C	LYS12
D	LYS12
D	HIS40
D	LYS72
F	GOL102

---

site_id	BC5
Number of Residues	2
Details	BINDING SITE FOR RESIDUE GOL D 103

Chain	Residue
D	TYR35
D	GLU36

---

site_id	BC6
Number of Residues	4
Details	BINDING SITE FOR RESIDUE SO4 D 104

Chain	Residue
D	ARG48
D	ASP83
D	VAL84
D	GLU85

---

site_id	BC7
Number of Residues	6
Details	BINDING SITE FOR RESIDUE GOL E 101

Chain	Residue
B	ARG66
B	ASN67
B	GLY69
E	ALA26
E	SER27
E	ALA28

---

site_id	BC8
Number of Residues	4
Details	BINDING SITE FOR RESIDUE GOL E 102

Chain	Residue
A	LYS12
E	LYS12
E	HIS40
E	LYS72

---

site_id	BC9
Number of Residues	4
Details	BINDING SITE FOR RESIDUE SO4 E 103

Chain	Residue
C	LYS37
C	PGO102
C	HOH228
E	LYS37

---

site_id	CC1
Number of Residues	4
Details	BINDING SITE FOR RESIDUE SO4 F 101

Chain	Residue
C	PGO102
D	HOH232
E	ILE38
F	LYS37

---

site_id	CC2
Number of Residues	5
Details	BINDING SITE FOR RESIDUE GOL F 102

Chain	Residue
A	SO4104
A	HOH236
D	TAR102
F	HIS40
A	HIS40

---

site_id	CC3
Number of Residues	3
Details	BINDING SITE FOR RESIDUE GOL F 103

Chain	Residue
A	LYS72
A	SO4104
F	LYS12

---

site_id	CC4
Number of Residues	16
Details	BINDING SITE FOR RESIDUE TAR G 101

Chain	Residue
G	GLY39
G	GLY39
G	HIS40
G	HIS40
H	GLY39
H	GLY39
H	HIS40
H	HIS40
H	SO4102
H	SO4102
H	HOH206
H	HOH206
I	GLY39
I	GLY39
I	HIS40
I	HIS40

---

site_id	CC5
Number of Residues	4
Details	BINDING SITE FOR RESIDUE GOL G 102

Chain	Residue
A	HOH229
G	ALA56
G	ASP59
G	ALA60

---

site_id	CC6
Number of Residues	4
Details	BINDING SITE FOR RESIDUE SO4 G 103

Chain	Residue
G	LYS12
G	HIS40
G	LYS72
H	LYS12

---

site_id	CC7
Number of Residues	4
Details	BINDING SITE FOR RESIDUE GOL H 101

Chain	Residue
H	ARG48
H	HIS81
H	VAL84
H	GLU85

---

site_id	CC8
Number of Residues	8
Details	BINDING SITE FOR RESIDUE SO4 H 102

Chain	Residue
G	HIS40
G	TAR101
G	TAR101
H	HIS40
H	HIS40
H	HOH226
H	HOH226
I	HIS40

---

site_id	CC9
Number of Residues	5
Details	BINDING SITE FOR RESIDUE SO4 H 103

Chain	Residue
H	GLU36
H	LYS37
H	PRO89
H	GLY91
I	LYS37

---

site_id	DC1
Number of Residues	4
Details	BINDING SITE FOR RESIDUE PGO I 101

Chain	Residue
G	LYS12
I	LYS12
I	HIS40
I	LYS72

---

Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	504
Details	Domain: {"description":"BMC","evidences":[{"source":"PROSITE-ProRule","id":"PRU01278","evidenceCode":"ECO:0000255"}]}

Chain

Residue

Details

---