ID	4RMNA	STANDARD;	PRT;	524	AA.
DT	CONVERTED FROM PDB (SEQRES) 4RMN
DE	Benzoate-coenzyme A ligase
OS	Rhodopseudomonas palustris
CC	EXPDTA	X-RAY DIFFRACTION
CC	RESOLU	1.720
CC	R-Factor	0.158
FT	#SUB	211	 211 	HIS	A	341	 341 	ASP	B	Protein	S	6
FT	#SUB	213	 213 	ARG	A	341	 341 	ASP	B	Protein	S	4
FT	#SUB	213	 213 	ARG	A	342	 342 	ARG	B	Protein	S	5
FT	#SUB	291	 291 	ARG	A	291	 291 	ARG	B	Protein	S	1
FT	#SUB	291	 291 	ARG	A	315	 315 	GLN	B	Protein	S	5
FT	#SUB	291	 291 	ARG	A	316	 316 	ARG	B	Protein	S	6
FT	#SUB	291	 291 	ARG	A	319	 319 	GLY	B	Protein	S	4
FT	#SUB	297	 297 	ARG	A	341	 341 	ASP	B	Protein	S	1
FT	#SUB	315	 315 	GLN	A	291	 291 	ARG	B	Protein	A	4
FT	#SUB	316	 316 	ARG	A	291	 291 	ARG	B	Protein	B	4
FT	#SUB	317	 317 	HIS	A	291	 291 	ARG	B	Protein	B	2
FT	#SUB	318	 318 	PHE	A	291	 291 	ARG	B	Protein	B	1
FT	#SUB	319	 319 	GLY	A	291	 291 	ARG	B	Protein	B	6
FT	#SUB	319	 319 	GLY	A	319	 319 	GLY	B	Protein	B	1
FT	#SUB	341	 341 	ASP	A	211	 211 	HIS	B	Protein	S	5
FT	#SUB	341	 341 	ASP	A	213	 213 	ARG	B	Protein	B	4
FT	#SUB	341	 341 	ASP	A	297	 297 	ARG	B	Protein	B	1
FT	#SUB	342	 342 	ARG	A	213	 213 	ARG	B	Protein	A	7
FT	#HET	221	 221 	ALA	A	2	1001 	C21	A	A	5
FT	#HET	222	 222 	ALA	A	2	1001 	C21	A	A	16
FT	#HET	226	 226 	PHE	A	2	1001 	C21	A	S	10
FT	#HET	227	 227 	ALA	A	1	1000 	C21	A	A	2
FT	#HET	228	 228 	TYR	A	1	1000 	C21	A	A	8
FT	#HET	228	 228 	TYR	A	2	1001 	C21	A	S	6
FT	#HET	274	 274 	GLY	A	2	1001 	C21	A	B	5
FT	#HET	275	 275 	ALA	A	2	1001 	C21	A	A	13
FT	#HET	302	 302 	ALA	A	1	1000 	C21	A	S	2
FT	#HET	302	 302 	ALA	A	2	1001 	C21	A	B	5
FT	#HET	303	 303 	GLY	A	1	1000 	C21	A	B	5
FT	#HET	303	 303 	GLY	A	2	1001 	C21	A	B	1
FT	#HET	305	 305 	ALA	A	3	1002 	GOL	A	A	5
FT	#HET	306	 306 	LEU	A	3	1002 	GOL	A	B	3
FT	#HET	324	 324 	ASP	A	3	1002 	GOL	A	S	4
FT	#HET	326	 326 	ILE	A	1	1000 	C21	A	A	3
FT	#HET	327	 327 	GLY	A	1	1000 	C21	A	B	18
FT	#HET	328	 328 	SER	A	1	1000 	C21	A	B	4
FT	#HET	332	 332 	LEU	A	1	1000 	C21	A	B	1
FT	#HET	333	 333 	HIS	A	1	1000 	C21	A	A	6
FT	#HET	334	 334 	ILE	A	1	1000 	C21	A	S	2
FT	#HET	346	 346 	GLY	A	3	1002 	GOL	A	B	4
FT	#HET	347	 347 	THR	A	3	1002 	GOL	A	B	10
FT	#HET	348	 348 	THR	A	3	1002 	GOL	A	A	8
FT	#HET	416	 416 	TYR	A	3	1002 	GOL	A	B	1
FT	#HET	417	 417 	THR	A	3	1002 	GOL	A	B	2
FT	#HET	418	 418 	TYR	A	3	1002 	GOL	A	A	6
FT	#HET	427	 427 	LYS	A	1	1000 	C21	A	S	4
FT	#HET	429	 429 	SER	A	2	1001 	C21	A	B	1
FT	#HET	430	 430 	GLY	A	2	1001 	C21	A	B	11
FT	DISORDER	1	5
FT	DISORDER	524	524
CC	SEQUENCE	518 AA (ATOM);
CC	VTPPPEKFNF AEHLLQTNRV RPDKTAFVDD ISSLSFAQLE AQTRQLAAAL RAIGVKREER
CC	VLLLMLDGTD WPVAFLGAIY AGIVPVAVNT LLTADDYAYM LEHSRAQAVL VSGALHPVLK
CC	AALTKSDHEV QRVIVSRPAA PLEPGEVDFA EFVGAHAPLE KPAATQADDP AFWLYSSGST
CC	GRPKGVVHTH ANPYWTSELY GRNTLHLRED DVCFSAAKLF FAYGLGNALT FPMTVGATTL
CC	LMGERPTPDA VFKRWLGGVG GVKPTVFYGA PTGYAGMLAA PNLPSRDQVA LRLASSAGEA
CC	LPAEIGQRFQ RHFGLDIVDG IGSTEMLHIF LSNLPDRVRY GTTGWPVPGY QIELRGDGGG
CC	PVADGEPGDL YIHGPSSATM YWGNRAKSRD TFQGGWTKSG DKYVRNDDGS YTYAGRTDDM
CC	LKVSGIYVSP FEIEATLVQH PGVLEAAVVG VADEHGLTKP KAYVVPRPGQ TLSETELKTF
CC	IKDRLAPYKY PRSTVFVAEL PKTATGKIQR FKLREGVL
CC	!----
CC	ALIGNMENT OF SEQRES AND ATOMRES
CC	SEQRES MNAAAVTPPPEKFNFAEHLLQTNRVRPDKTAFVDDISSLSFAQLEAQTRQ
CC	ATOM   -----VTPPPEKFNFAEHLLQTNRVRPDKTAFVDDISSLSFAQLEAQTRQ
CC	            *********************************************
CC	SEQRES LAAALRAIGVKREERVLLLMLDGTDWPVAFLGAIYAGIVPVAVNTLLTAD
CC	ATOM   LAAALRAIGVKREERVLLLMLDGTDWPVAFLGAIYAGIVPVAVNTLLTAD
CC	       **************************************************
CC	SEQRES DYAYMLEHSRAQAVLVSGALHPVLKAALTKSDHEVQRVIVSRPAAPLEPG
CC	ATOM   DYAYMLEHSRAQAVLVSGALHPVLKAALTKSDHEVQRVIVSRPAAPLEPG
CC	       **************************************************
CC	SEQRES EVDFAEFVGAHAPLEKPAATQADDPAFWLYSSGSTGRPKGVVHTHANPYW
CC	ATOM   EVDFAEFVGAHAPLEKPAATQADDPAFWLYSSGSTGRPKGVVHTHANPYW
CC	       **************************************************
CC	SEQRES TSELYGRNTLHLREDDVCFSAAKLFFAYGLGNALTFPMTVGATTLLMGER
CC	ATOM   TSELYGRNTLHLREDDVCFSAAKLFFAYGLGNALTFPMTVGATTLLMGER
CC	       **************************************************
CC	SEQRES PTPDAVFKRWLGGVGGVKPTVFYGAPTGYAGMLAAPNLPSRDQVALRLAS
CC	ATOM   PTPDAVFKRWLGGVGGVKPTVFYGAPTGYAGMLAAPNLPSRDQVALRLAS
CC	       **************************************************
CC	SEQRES SAGEALPAEIGQRFQRHFGLDIVDGIGSTEMLHIFLSNLPDRVRYGTTGW
CC	ATOM   SAGEALPAEIGQRFQRHFGLDIVDGIGSTEMLHIFLSNLPDRVRYGTTGW
CC	       **************************************************
CC	SEQRES PVPGYQIELRGDGGGPVADGEPGDLYIHGPSSATMYWGNRAKSRDTFQGG
CC	ATOM   PVPGYQIELRGDGGGPVADGEPGDLYIHGPSSATMYWGNRAKSRDTFQGG
CC	       **************************************************
CC	SEQRES WTKSGDKYVRNDDGSYTYAGRTDDMLKVSGIYVSPFEIEATLVQHPGVLE
CC	ATOM   WTKSGDKYVRNDDGSYTYAGRTDDMLKVSGIYVSPFEIEATLVQHPGVLE
CC	       **************************************************
CC	SEQRES AAVVGVADEHGLTKPKAYVVPRPGQTLSETELKTFIKDRLAPYKYPRSTV
CC	ATOM   AAVVGVADEHGLTKPKAYVVPRPGQTLSETELKTFIKDRLAPYKYPRSTV
CC	       **************************************************
CC	SEQRES FVAELPKTATGKIQRFKLREGVLG
CC	ATOM   FVAELPKTATGKIQRFKLREGVL-
CC	       *********************** 
SQ	SEQUENCE	524 AA;      MW;         CN;
	MNAAAVTPPP EKFNFAEHLL QTNRVRPDKT AFVDDISSLS FAQLEAQTRQ LAAALRAIGV
	KREERVLLLM LDGTDWPVAF LGAIYAGIVP VAVNTLLTAD DYAYMLEHSR AQAVLVSGAL
	HPVLKAALTK SDHEVQRVIV SRPAAPLEPG EVDFAEFVGA HAPLEKPAAT QADDPAFWLY
	SSGSTGRPKG VVHTHANPYW TSELYGRNTL HLREDDVCFS AAKLFFAYGL GNALTFPMTV
	GATTLLMGER PTPDAVFKRW LGGVGGVKPT VFYGAPTGYA GMLAAPNLPS RDQVALRLAS
	SAGEALPAEI GQRFQRHFGL DIVDGIGSTE MLHIFLSNLP DRVRYGTTGW PVPGYQIELR
	GDGGGPVADG EPGDLYIHGP SSATMYWGNR AKSRDTFQGG WTKSGDKYVR NDDGSYTYAG
	RTDDMLKVSG IYVSPFEIEA TLVQHPGVLE AAVVGVADEH GLTKPKAYVV PRPGQTLSET
	ELKTFIKDRL APYKYPRSTV FVAELPKTAT GKIQRFKLRE GVLG
//
ID	4RMNB	STANDARD;	PRT;	524	AA.
DT	CONVERTED FROM PDB (SEQRES) 4RMN
DE	Benzoate-coenzyme A ligase
OS	Rhodopseudomonas palustris
CC	EXPDTA	X-RAY DIFFRACTION
CC	RESOLU	1.720
CC	R-Factor	0.158
FT	#SUB	211	 211 	HIS	B	341	 341 	ASP	A	Protein	S	5
FT	#SUB	213	 213 	ARG	B	341	 341 	ASP	A	Protein	S	4
FT	#SUB	213	 213 	ARG	B	342	 342 	ARG	A	Protein	S	7
FT	#SUB	291	 291 	ARG	B	291	 291 	ARG	A	Protein	S	1
FT	#SUB	291	 291 	ARG	B	315	 315 	GLN	A	Protein	S	4
FT	#SUB	291	 291 	ARG	B	316	 316 	ARG	A	Protein	S	4
FT	#SUB	291	 291 	ARG	B	317	 317 	HIS	A	Protein	S	2
FT	#SUB	291	 291 	ARG	B	318	 318 	PHE	A	Protein	S	1
FT	#SUB	291	 291 	ARG	B	319	 319 	GLY	A	Protein	S	6
FT	#SUB	297	 297 	ARG	B	341	 341 	ASP	A	Protein	S	1
FT	#SUB	315	 315 	GLN	B	291	 291 	ARG	A	Protein	A	5
FT	#SUB	316	 316 	ARG	B	291	 291 	ARG	A	Protein	B	6
FT	#SUB	319	 319 	GLY	B	291	 291 	ARG	A	Protein	B	4
FT	#SUB	319	 319 	GLY	B	319	 319 	GLY	A	Protein	B	1
FT	#SUB	341	 341 	ASP	B	211	 211 	HIS	A	Protein	S	6
FT	#SUB	341	 341 	ASP	B	213	 213 	ARG	A	Protein	B	4
FT	#SUB	341	 341 	ASP	B	297	 297 	ARG	A	Protein	B	1
FT	#SUB	342	 342 	ARG	B	213	 213 	ARG	A	Protein	A	5
FT	#HET	10	  10 	PRO	B	11	1007 	GOL	B	S	1
FT	#HET	13	  13 	PHE	B	11	1007 	GOL	B	A	4
FT	#HET	14	  14 	ASN	B	11	1007 	GOL	B	B	4
FT	#HET	17	  17 	GLU	B	11	1007 	GOL	B	S	3
FT	#HET	18	  18 	HIS	B	11	1007 	GOL	B	B	2
FT	#HET	71	  71 	LEU	B	7	1003 	GOL	B	S	3
FT	#HET	75	  75 	ASP	B	10	1006 	GOL	B	S	4
FT	#HET	95	  95 	THR	B	7	1003 	GOL	B	A	5
FT	#HET	96	  96 	LEU	B	7	1003 	GOL	B	S	6
FT	#HET	97	  97 	LEU	B	8	1004 	GOL	B	S	2
FT	#HET	101	 101 	ASP	B	8	1004 	GOL	B	S	5
FT	#HET	140	 140 	VAL	B	10	1006 	GOL	B	B	1
FT	#HET	141	 141 	SER	B	10	1006 	GOL	B	B	2
FT	#HET	142	 142 	ARG	B	10	1006 	GOL	B	A	5
FT	#HET	143	 143 	PRO	B	10	1006 	GOL	B	S	2
FT	#HET	153	 153 	ASP	B	10	1006 	GOL	B	S	7
FT	#HET	154	 154 	PHE	B	10	1006 	GOL	B	A	4
FT	#HET	155	 155 	ALA	B	10	1006 	GOL	B	A	4
FT	#HET	182	 182 	SER	B	6	1002 	GOL	B	A	6
FT	#HET	182	 182 	SER	B	8	1004 	GOL	B	S	4
FT	#HET	183	 183 	GLY	B	6	1002 	GOL	B	B	8
FT	#HET	184	 184 	SER	B	6	1002 	GOL	B	B	2
FT	#HET	185	 185 	THR	B	6	1002 	GOL	B	B	5
FT	#HET	186	 186 	GLY	B	6	1002 	GOL	B	B	8
FT	#HET	187	 187 	ARG	B	6	1002 	GOL	B	B	2
FT	#HET	188	 188 	PRO	B	6	1002 	GOL	B	B	3
FT	#HET	188	 188 	PRO	B	8	1004 	GOL	B	S	3
FT	#HET	221	 221 	ALA	B	5	1001 	C21	B	A	3
FT	#HET	222	 222 	ALA	B	5	1001 	C21	B	A	15
FT	#HET	223	 223 	LYS	B	7	1003 	GOL	B	S	2
FT	#HET	226	 226 	PHE	B	5	1001 	C21	B	S	14
FT	#HET	227	 227 	ALA	B	4	1000 	C21	B	A	2
FT	#HET	228	 228 	TYR	B	4	1000 	C21	B	A	10
FT	#HET	228	 228 	TYR	B	5	1001 	C21	B	S	5
FT	#HET	248	 248 	GLY	B	7	1003 	GOL	B	B	2
FT	#HET	251	 251 	PRO	B	7	1003 	GOL	B	S	1
FT	#HET	274	 274 	GLY	B	5	1001 	C21	B	B	4
FT	#HET	275	 275 	ALA	B	5	1001 	C21	B	A	17
FT	#HET	302	 302 	ALA	B	4	1000 	C21	B	S	2
FT	#HET	302	 302 	ALA	B	5	1001 	C21	B	B	4
FT	#HET	303	 303 	GLY	B	4	1000 	C21	B	B	6
FT	#HET	303	 303 	GLY	B	5	1001 	C21	B	B	1
FT	#HET	326	 326 	ILE	B	4	1000 	C21	B	A	3
FT	#HET	327	 327 	GLY	B	4	1000 	C21	B	B	18
FT	#HET	328	 328 	SER	B	4	1000 	C21	B	B	4
FT	#HET	332	 332 	LEU	B	4	1000 	C21	B	B	1
FT	#HET	333	 333 	HIS	B	4	1000 	C21	B	A	5
FT	#HET	334	 334 	ILE	B	4	1000 	C21	B	A	3
FT	#HET	357	 357 	ILE	B	9	1005 	GOL	B	B	3
FT	#HET	358	 358 	GLU	B	9	1005 	GOL	B	B	3
FT	#HET	359	 359 	LEU	B	9	1005 	GOL	B	A	6
FT	#HET	410	 410 	ARG	B	9	1005 	GOL	B	S	6
FT	#HET	416	 416 	TYR	B	9	1005 	GOL	B	S	3
FT	#HET	427	 427 	LYS	B	4	1000 	C21	B	S	4
FT	#HET	429	 429 	SER	B	5	1001 	C21	B	B	5
FT	#HET	430	 430 	GLY	B	5	1001 	C21	B	B	8
FT	#HET	434	 434 	SER	B	6	1002 	GOL	B	S	1
FT	#HET	437	 437 	GLU	B	6	1002 	GOL	B	S	1
FT	#HET	437	 437 	GLU	B	8	1004 	GOL	B	S	2
FT	#HET	494	 494 	LYS	B	8	1004 	GOL	B	S	3
FT	DISORDER	1	5
CC	SEQUENCE	519 AA (ATOM);
CC	VTPPPEKFNF AEHLLQTNRV RPDKTAFVDD ISSLSFAQLE AQTRQLAAAL RAIGVKREER
CC	VLLLMLDGTD WPVAFLGAIY AGIVPVAVNT LLTADDYAYM LEHSRAQAVL VSGALHPVLK
CC	AALTKSDHEV QRVIVSRPAA PLEPGEVDFA EFVGAHAPLE KPAATQADDP AFWLYSSGST
CC	GRPKGVVHTH ANPYWTSELY GRNTLHLRED DVCFSAAKLF FAYGLGNALT FPMTVGATTL
CC	LMGERPTPDA VFKRWLGGVG GVKPTVFYGA PTGYAGMLAA PNLPSRDQVA LRLASSAGEA
CC	LPAEIGQRFQ RHFGLDIVDG IGSTEMLHIF LSNLPDRVRY GTTGWPVPGY QIELRGDGGG
CC	PVADGEPGDL YIHGPSSATM YWGNRAKSRD TFQGGWTKSG DKYVRNDDGS YTYAGRTDDM
CC	LKVSGIYVSP FEIEATLVQH PGVLEAAVVG VADEHGLTKP KAYVVPRPGQ TLSETELKTF
CC	IKDRLAPYKY PRSTVFVAEL PKTATGKIQR FKLREGVLG
CC	!----
CC	ALIGNMENT OF SEQRES AND ATOMRES
CC	SEQRES MNAAAVTPPPEKFNFAEHLLQTNRVRPDKTAFVDDISSLSFAQLEAQTRQ
CC	ATOM   -----VTPPPEKFNFAEHLLQTNRVRPDKTAFVDDISSLSFAQLEAQTRQ
CC	            *********************************************
CC	SEQRES LAAALRAIGVKREERVLLLMLDGTDWPVAFLGAIYAGIVPVAVNTLLTAD
CC	ATOM   LAAALRAIGVKREERVLLLMLDGTDWPVAFLGAIYAGIVPVAVNTLLTAD
CC	       **************************************************
CC	SEQRES DYAYMLEHSRAQAVLVSGALHPVLKAALTKSDHEVQRVIVSRPAAPLEPG
CC	ATOM   DYAYMLEHSRAQAVLVSGALHPVLKAALTKSDHEVQRVIVSRPAAPLEPG
CC	       **************************************************
CC	SEQRES EVDFAEFVGAHAPLEKPAATQADDPAFWLYSSGSTGRPKGVVHTHANPYW
CC	ATOM   EVDFAEFVGAHAPLEKPAATQADDPAFWLYSSGSTGRPKGVVHTHANPYW
CC	       **************************************************
CC	SEQRES TSELYGRNTLHLREDDVCFSAAKLFFAYGLGNALTFPMTVGATTLLMGER
CC	ATOM   TSELYGRNTLHLREDDVCFSAAKLFFAYGLGNALTFPMTVGATTLLMGER
CC	       **************************************************
CC	SEQRES PTPDAVFKRWLGGVGGVKPTVFYGAPTGYAGMLAAPNLPSRDQVALRLAS
CC	ATOM   PTPDAVFKRWLGGVGGVKPTVFYGAPTGYAGMLAAPNLPSRDQVALRLAS
CC	       **************************************************
CC	SEQRES SAGEALPAEIGQRFQRHFGLDIVDGIGSTEMLHIFLSNLPDRVRYGTTGW
CC	ATOM   SAGEALPAEIGQRFQRHFGLDIVDGIGSTEMLHIFLSNLPDRVRYGTTGW
CC	       **************************************************
CC	SEQRES PVPGYQIELRGDGGGPVADGEPGDLYIHGPSSATMYWGNRAKSRDTFQGG
CC	ATOM   PVPGYQIELRGDGGGPVADGEPGDLYIHGPSSATMYWGNRAKSRDTFQGG
CC	       **************************************************
CC	SEQRES WTKSGDKYVRNDDGSYTYAGRTDDMLKVSGIYVSPFEIEATLVQHPGVLE
CC	ATOM   WTKSGDKYVRNDDGSYTYAGRTDDMLKVSGIYVSPFEIEATLVQHPGVLE
CC	       **************************************************
CC	SEQRES AAVVGVADEHGLTKPKAYVVPRPGQTLSETELKTFIKDRLAPYKYPRSTV
CC	ATOM   AAVVGVADEHGLTKPKAYVVPRPGQTLSETELKTFIKDRLAPYKYPRSTV
CC	       **************************************************
CC	SEQRES FVAELPKTATGKIQRFKLREGVLG
CC	ATOM   FVAELPKTATGKIQRFKLREGVLG
CC	       ************************
SQ	SEQUENCE	524 AA;      MW;         CN;
	MNAAAVTPPP EKFNFAEHLL QTNRVRPDKT AFVDDISSLS FAQLEAQTRQ LAAALRAIGV
	KREERVLLLM LDGTDWPVAF LGAIYAGIVP VAVNTLLTAD DYAYMLEHSR AQAVLVSGAL
	HPVLKAALTK SDHEVQRVIV SRPAAPLEPG EVDFAEFVGA HAPLEKPAAT QADDPAFWLY
	SSGSTGRPKG VVHTHANPYW TSELYGRNTL HLREDDVCFS AAKLFFAYGL GNALTFPMTV
	GATTLLMGER PTPDAVFKRW LGGVGGVKPT VFYGAPTGYA GMLAAPNLPS RDQVALRLAS
	SAGEALPAEI GQRFQRHFGL DIVDGIGSTE MLHIFLSNLP DRVRYGTTGW PVPGYQIELR
	GDGGGPVADG EPGDLYIHGP SSATMYWGNR AKSRDTFQGG WTKSGDKYVR NDDGSYTYAG
	RTDDMLKVSG IYVSPFEIEA TLVQHPGVLE AAVVGVADEH GLTKPKAYVV PRPGQTLSET
	ELKTFIKDRL APYKYPRSTV FVAELPKTAT GKIQRFKLRE GVLG
//