ID	3NNTA	STANDARD;	PRT;	276	AA.
DT	CONVERTED FROM PDB (SEQRES) 3NNT
DE	3-dehydroquinate dehydratase
OS	Salmonella enterica subsp. enterica serovar Typhimurium
CC	EXPDTA	X-RAY DIFFRACTION
CC	RESOLU	1.600
CC	R-Factor	0.159
FT	#SUB	202	 178 	LYS	A	213	 189 	VAL	B	Protein	S	1
FT	#SUB	202	 178 	LYS	A	217	 193 	GLU	B	Protein	S	1
FT	#SUB	202	 178 	LYS	A	242	 218 	VAL	B	Protein	S	7
FT	#SUB	202	 178 	LYS	A	243	 219 	PHE	B	Protein	B	1
FT	#SUB	205	 181 	VAL	A	243	 219 	PHE	B	Protein	S	1
FT	#SUB	206	 182 	LEU	A	209	 185 	LEU	B	Protein	S	4
FT	#SUB	206	 182 	LEU	A	210	 186 	THR	B	Protein	S	3
FT	#SUB	206	 182 	LEU	A	243	 219 	PHE	B	Protein	S	3
FT	#SUB	209	 185 	LEU	A	206	 182 	LEU	B	Protein	A	3
FT	#SUB	209	 185 	LEU	A	235	 211 	ILE	B	Protein	S	1
FT	#SUB	210	 186 	THR	A	206	 182 	LEU	B	Protein	A	3
FT	#SUB	213	 189 	VAL	A	202	 178 	LYS	B	Protein	S	1
FT	#SUB	217	 193 	GLU	A	202	 178 	LYS	B	Protein	S	3
FT	#SUB	231	 207 	LYS	A	273	 249 	LEU	B	Protein	S	1
FT	#SUB	231	 207 	LYS	A	274	 250 	HIS	B	Protein	S	1
FT	#SUB	231	 207 	LYS	A	275	 251 	GLN	B	Protein	S	1
FT	#SUB	232	 208 	THR	A	242	 218 	VAL	B	Protein	A	2
FT	#SUB	234	 210 	VAL	A	273	 249 	LEU	B	Protein	S	1
FT	#SUB	235	 211 	ILE	A	235	 211 	ILE	B	Protein	S	2
FT	#SUB	235	 211 	ILE	A	239	 215 	ALA	B	Protein	S	2
FT	#SUB	235	 211 	ILE	A	243	 219 	PHE	B	Protein	S	1
FT	#SUB	238	 214 	LEU	A	273	 249 	LEU	B	Protein	S	1
FT	#SUB	242	 218 	VAL	A	202	 178 	LYS	B	Protein	B	3
FT	#SUB	242	 218 	VAL	A	232	 208 	THR	B	Protein	S	1
FT	#SUB	243	 219 	PHE	A	205	 181 	VAL	B	Protein	S	1
FT	#SUB	243	 219 	PHE	A	206	 182 	LEU	B	Protein	S	3
FT	#SUB	243	 219 	PHE	A	235	 211 	ILE	B	Protein	S	3
FT	#SUB	261	 237 	ILE	A	272	 248 	ILE	B	Protein	S	1
FT	#SUB	265	 241 	ASP	A	272	 248 	ILE	B	Protein	A	5
FT	#SUB	265	 241 	ASP	A	275	 251 	GLN	B	Protein	S	1
FT	#SUB	268	 244 	THR	A	268	 244 	THR	B	Protein	S	1
FT	#SUB	269	 245 	VAL	A	272	 248 	ILE	B	Protein	S	1
FT	#SUB	272	 248 	ILE	A	261	 237 	ILE	B	Protein	S	1
FT	#SUB	272	 248 	ILE	A	265	 241 	ASP	B	Protein	S	7
FT	#SUB	272	 248 	ILE	A	269	 245 	VAL	B	Protein	S	1
FT	#SUB	273	 249 	LEU	A	238	 214 	LEU	B	Protein	S	1
FT	#HET	45	  21 	SER	A	1	253 	DQA	A	S	1
FT	#HET	70	  46 	GLU	A	1	253 	DQA	A	S	10
FT	#HET	72	  48 	ARG	A	1	253 	DQA	A	S	4
FT	#HET	106	  82 	ARG	A	1	253 	DQA	A	S	4
FT	#HET	167	 143 	HIS	A	1	253 	DQA	A	S	2
FT	#HET	194	 170 	MET	A	1	253 	DQA	A	S	2
FT	#HET	229	 205 	MET	A	1	253 	DQA	A	S	2
FT	#HET	237	 213 	ARG	A	1	253 	DQA	A	S	8
FT	#HET	249	 225 	PHE	A	1	253 	DQA	A	S	8
FT	#HET	256	 232 	SER	A	1	253 	DQA	A	S	3
FT	#HET	257	 233 	ALA	A	1	253 	DQA	A	S	6
FT	#HET	260	 236 	GLN	A	1	253 	DQA	A	S	5
FT	DISORDER	1	18
FT	DISORDER	276	276
CC	SEQUENCE	257 AA (ATOM);
CC	YFQSNAMKTV TVRDLVVGEG APKIIVSLMG KTITDVKSEA LAYREADFDI LEWRVDHFAN
CC	VTTAESVLEA AGAIREIITD KPLLFTFRSA KEGGEQALTT GQYIDLNRAA VDSGLVDMID
CC	LELFTGDDEV KATVGYAHQH NVAVIMSNHD FHKTPAAEEI VQRLRKMQEL GADIPMIAVM
CC	PQTKADVLTL LTATVEMQER YADRPIITMS MSKTGVISRL AGEVFGSAAT FGAVKKASAP
CC	GQISVADLRT VLTILHQ
CC	!----
CC	ALIGNMENT OF SEQRES AND ATOMRES
CC	SEQRES MHHHHHHSSGVDLGTENLYFQSNAMKTVTVRDLVVGEGAPKIIVSLMGKT
CC	ATOM   ------------------YFQSNAMKTVTVRDLVVGEGAPKIIVSLMGKT
CC	                         ********************************
CC	SEQRES ITDVKSEALAYREADFDILEWRVDHFANVTTAESVLEAAGAIREIITDKP
CC	ATOM   ITDVKSEALAYREADFDILEWRVDHFANVTTAESVLEAAGAIREIITDKP
CC	       **************************************************
CC	SEQRES LLFTFRSAKEGGEQALTTGQYIDLNRAAVDSGLVDMIDLELFTGDDEVKA
CC	ATOM   LLFTFRSAKEGGEQALTTGQYIDLNRAAVDSGLVDMIDLELFTGDDEVKA
CC	       **************************************************
CC	SEQRES TVGYAHQHNVAVIMSNHDFHKTPAAEEIVQRLRKMQELGADIPMIAVMPQ
CC	ATOM   TVGYAHQHNVAVIMSNHDFHKTPAAEEIVQRLRKMQELGADIPMIAVMPQ
CC	       **************************************************
CC	SEQRES TKADVLTLLTATVEMQERYADRPIITMSMSKTGVISRLAGEVFGSAATFG
CC	ATOM   TKADVLTLLTATVEMQERYADRPIITMSMSKTGVISRLAGEVFGSAATFG
CC	       **************************************************
CC	SEQRES AVKKASAPGQISVADLRTVLTILHQA
CC	ATOM   AVKKASAPGQISVADLRTVLTILHQ-
CC	       ************************* 
SQ	SEQUENCE	276 AA;      MW;         CN;
	MHHHHHHSSG VDLGTENLYF QSNAMKTVTV RDLVVGEGAP KIIVSLMGKT ITDVKSEALA
	YREADFDILE WRVDHFANVT TAESVLEAAG AIREIITDKP LLFTFRSAKE GGEQALTTGQ
	YIDLNRAAVD SGLVDMIDLE LFTGDDEVKA TVGYAHQHNV AVIMSNHDFH KTPAAEEIVQ
	RLRKMQELGA DIPMIAVMPQ TKADVLTLLT ATVEMQERYA DRPIITMSMS KTGVISRLAG
	EVFGSAATFG AVKKASAPGQ ISVADLRTVL TILHQA
//
ID	3NNTB	STANDARD;	PRT;	276	AA.
DT	CONVERTED FROM PDB (SEQRES) 3NNT
DE	3-dehydroquinate dehydratase
OS	Salmonella enterica subsp. enterica serovar Typhimurium
CC	EXPDTA	X-RAY DIFFRACTION
CC	RESOLU	1.600
CC	R-Factor	0.159
FT	#SUB	202	 178 	LYS	B	213	 189 	VAL	A	Protein	S	1
FT	#SUB	202	 178 	LYS	B	217	 193 	GLU	A	Protein	S	3
FT	#SUB	202	 178 	LYS	B	242	 218 	VAL	A	Protein	S	3
FT	#SUB	205	 181 	VAL	B	243	 219 	PHE	A	Protein	S	1
FT	#SUB	206	 182 	LEU	B	209	 185 	LEU	A	Protein	S	3
FT	#SUB	206	 182 	LEU	B	210	 186 	THR	A	Protein	S	3
FT	#SUB	206	 182 	LEU	B	243	 219 	PHE	A	Protein	S	3
FT	#SUB	209	 185 	LEU	B	206	 182 	LEU	A	Protein	A	4
FT	#SUB	210	 186 	THR	B	206	 182 	LEU	A	Protein	A	3
FT	#SUB	213	 189 	VAL	B	202	 178 	LYS	A	Protein	S	1
FT	#SUB	217	 193 	GLU	B	202	 178 	LYS	A	Protein	S	1
FT	#SUB	232	 208 	THR	B	242	 218 	VAL	A	Protein	B	1
FT	#SUB	235	 211 	ILE	B	209	 185 	LEU	A	Protein	S	1
FT	#SUB	235	 211 	ILE	B	235	 211 	ILE	A	Protein	S	2
FT	#SUB	235	 211 	ILE	B	243	 219 	PHE	A	Protein	S	3
FT	#SUB	238	 214 	LEU	B	273	 249 	LEU	A	Protein	S	1
FT	#SUB	239	 215 	ALA	B	235	 211 	ILE	A	Protein	S	2
FT	#SUB	242	 218 	VAL	B	202	 178 	LYS	A	Protein	A	7
FT	#SUB	242	 218 	VAL	B	232	 208 	THR	A	Protein	S	2
FT	#SUB	243	 219 	PHE	B	202	 178 	LYS	A	Protein	S	1
FT	#SUB	243	 219 	PHE	B	205	 181 	VAL	A	Protein	S	1
FT	#SUB	243	 219 	PHE	B	206	 182 	LEU	A	Protein	S	3
FT	#SUB	243	 219 	PHE	B	235	 211 	ILE	A	Protein	S	1
FT	#SUB	261	 237 	ILE	B	272	 248 	ILE	A	Protein	S	1
FT	#SUB	265	 241 	ASP	B	272	 248 	ILE	A	Protein	S	7
FT	#SUB	268	 244 	THR	B	268	 244 	THR	A	Protein	S	1
FT	#SUB	269	 245 	VAL	B	272	 248 	ILE	A	Protein	S	1
FT	#SUB	272	 248 	ILE	B	261	 237 	ILE	A	Protein	S	1
FT	#SUB	272	 248 	ILE	B	265	 241 	ASP	A	Protein	S	5
FT	#SUB	272	 248 	ILE	B	269	 245 	VAL	A	Protein	S	1
FT	#SUB	273	 249 	LEU	B	231	 207 	LYS	A	Protein	B	1
FT	#SUB	273	 249 	LEU	B	234	 210 	VAL	A	Protein	S	1
FT	#SUB	273	 249 	LEU	B	238	 214 	LEU	A	Protein	S	1
FT	#SUB	274	 250 	HIS	B	231	 207 	LYS	A	Protein	B	1
FT	#SUB	275	 251 	GLN	B	231	 207 	LYS	A	Protein	B	1
FT	#SUB	275	 251 	GLN	B	265	 241 	ASP	A	Protein	S	1
FT	#HET	45	  21 	SER	B	2	253 	DQA	B	S	1
FT	#HET	70	  46 	GLU	B	2	253 	DQA	B	S	10
FT	#HET	72	  48 	ARG	B	2	253 	DQA	B	S	5
FT	#HET	106	  82 	ARG	B	2	253 	DQA	B	S	4
FT	#HET	167	 143 	HIS	B	2	253 	DQA	B	S	8
FT	#HET	194	 170 	MET	B	2	253 	DQA	B	S	2
FT	#HET	227	 203 	MET	B	2	253 	DQA	B	S	1
FT	#HET	229	 205 	MET	B	2	253 	DQA	B	S	2
FT	#HET	237	 213 	ARG	B	2	253 	DQA	B	S	8
FT	#HET	249	 225 	PHE	B	2	253 	DQA	B	S	7
FT	#HET	256	 232 	SER	B	2	253 	DQA	B	S	4
FT	#HET	257	 233 	ALA	B	2	253 	DQA	B	S	5
FT	#HET	260	 236 	GLN	B	2	253 	DQA	B	S	4
FT	DISORDER	1	18
FT	DISORDER	276	276
CC	SEQUENCE	257 AA (ATOM);
CC	YFQSNAMKTV TVRDLVVGEG APKIIVSLMG KTITDVKSEA LAYREADFDI LEWRVDHFAN
CC	VTTAESVLEA AGAIREIITD KPLLFTFRSA KEGGEQALTT GQYIDLNRAA VDSGLVDMID
CC	LELFTGDDEV KATVGYAHQH NVAVIMSNHD FHKTPAAEEI VQRLRKMQEL GADIPMIAVM
CC	PQTKADVLTL LTATVEMQER YADRPIITMS MSKTGVISRL AGEVFGSAAT FGAVKKASAP
CC	GQISVADLRT VLTILHQ
CC	!----
CC	ALIGNMENT OF SEQRES AND ATOMRES
CC	SEQRES MHHHHHHSSGVDLGTENLYFQSNAMKTVTVRDLVVGEGAPKIIVSLMGKT
CC	ATOM   ------------------YFQSNAMKTVTVRDLVVGEGAPKIIVSLMGKT
CC	                         ********************************
CC	SEQRES ITDVKSEALAYREADFDILEWRVDHFANVTTAESVLEAAGAIREIITDKP
CC	ATOM   ITDVKSEALAYREADFDILEWRVDHFANVTTAESVLEAAGAIREIITDKP
CC	       **************************************************
CC	SEQRES LLFTFRSAKEGGEQALTTGQYIDLNRAAVDSGLVDMIDLELFTGDDEVKA
CC	ATOM   LLFTFRSAKEGGEQALTTGQYIDLNRAAVDSGLVDMIDLELFTGDDEVKA
CC	       **************************************************
CC	SEQRES TVGYAHQHNVAVIMSNHDFHKTPAAEEIVQRLRKMQELGADIPMIAVMPQ
CC	ATOM   TVGYAHQHNVAVIMSNHDFHKTPAAEEIVQRLRKMQELGADIPMIAVMPQ
CC	       **************************************************
CC	SEQRES TKADVLTLLTATVEMQERYADRPIITMSMSKTGVISRLAGEVFGSAATFG
CC	ATOM   TKADVLTLLTATVEMQERYADRPIITMSMSKTGVISRLAGEVFGSAATFG
CC	       **************************************************
CC	SEQRES AVKKASAPGQISVADLRTVLTILHQA
CC	ATOM   AVKKASAPGQISVADLRTVLTILHQ-
CC	       ************************* 
SQ	SEQUENCE	276 AA;      MW;         CN;
	MHHHHHHSSG VDLGTENLYF QSNAMKTVTV RDLVVGEGAP KIIVSLMGKT ITDVKSEALA
	YREADFDILE WRVDHFANVT TAESVLEAAG AIREIITDKP LLFTFRSAKE GGEQALTTGQ
	YIDLNRAAVD SGLVDMIDLE LFTGDDEVKA TVGYAHQHNV AVIMSNHDFH KTPAAEEIVQ
	RLRKMQELGA DIPMIAVMPQ TKADVLTLLT ATVEMQERYA DRPIITMSMS KTGVISRLAG
	EVFGSAATFG AVKKASAPGQ ISVADLRTVL TILHQA
//