5I9M

Crystal structure of B. pseudomallei FabI in complex with NAD and PT408

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0000166	molecular_function	nucleotide binding
A	0004318	molecular_function	enoyl-[acyl-carrier-protein] reductase (NADH) activity
A	0006633	biological_process	fatty acid biosynthetic process
A	0016491	molecular_function	oxidoreductase activity
B	0000166	molecular_function	nucleotide binding
B	0004318	molecular_function	enoyl-[acyl-carrier-protein] reductase (NADH) activity
B	0006633	biological_process	fatty acid biosynthetic process
B	0016491	molecular_function	oxidoreductase activity
C	0000166	molecular_function	nucleotide binding
C	0004318	molecular_function	enoyl-[acyl-carrier-protein] reductase (NADH) activity
C	0006633	biological_process	fatty acid biosynthetic process
C	0016491	molecular_function	oxidoreductase activity

Functional Information from PDB Data

site_id	AC1
Number of Residues	29
Details	binding site for residue NAD A 301

Chain	Residue
A	GLY13
A	ILE92
A	GLY93
A	ILE119
A	LEU144
A	SER145
A	LYS163
A	ALA189
A	GLY190
A	PRO191
A	ILE192
A	LEU15
A	THR194
A	LEU195
A	ALA196
A	69K302
A	HOH426
A	HOH446
A	HOH457
A	HOH465
A	HOH468
A	HOH485
A	SER19
A	ILE20
A	VAL40
A	CYS63
A	ASP64
A	VAL65
A	SER91

---

site_id	AC2
Number of Residues	8
Details	binding site for residue 69K A 302

Chain	Residue
A	GLY93
A	ILE100
A	TYR156
A	LYS163
A	ALA196
A	ALA197
A	PHE203
A	NAD301

---

site_id	AC3
Number of Residues	26
Details	binding site for residue NAD B 301

Chain	Residue
B	GLY13
B	LEU15
B	SER19
B	ILE20
B	VAL40
B	CYS63
B	ASP64
B	VAL65
B	SER91
B	ILE92
B	GLY93
B	ILE119
B	LEU144
B	SER145
B	TYR146
B	LYS163
B	PRO191
B	ILE192
B	THR194
B	ALA196
B	69K302
B	HOH411
B	HOH413
B	HOH415
B	HOH439
B	HOH446

---

site_id	AC4
Number of Residues	9
Details	binding site for residue 69K B 302

Chain	Residue
B	GLY93
B	PHE94
B	ALA95
B	TYR156
B	LYS163
B	ALA196
B	ALA197
B	PHE203
B	NAD301

---

site_id	AC5
Number of Residues	27
Details	binding site for residue NAD C 301

Chain	Residue
C	GLY13
C	LEU15
C	SER19
C	ILE20
C	VAL40
C	CYS63
C	ASP64
C	VAL65
C	SER91
C	ILE92
C	GLY93
C	ILE119
C	LEU144
C	SER145
C	TYR146
C	LYS163
C	ALA189
C	PRO191
C	ILE192
C	THR194
C	ALA196
C	69K302
C	HOH406
C	HOH417
C	HOH438
C	HOH452
C	HOH476

---

site_id	AC6
Number of Residues	8
Details	binding site for residue 69K C 302

Chain	Residue
C	GLY93
C	TYR146
C	TYR156
C	LYS163
C	ALA196
C	ALA197
C	PHE203
C	NAD301

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