ID	3G4FA	STANDARD;	PRT;	554	AA.
DT	CONVERTED FROM PDB (SEQRES) 3G4F
DE	(+)-delta-cadinene synthase isozyme XC1
OS	Gossypium arboreum
CC	EXPDTA	X-RAY DIFFRACTION
CC	RESOLU	2.650
CC	R-Factor	0.206
FT	#SUB	25	  25 	ALA	A	176	 176 	SER	B	Protein	B	2
FT	#SUB	25	  25 	ALA	A	179	 179 	THR	B	Protein	B	2
FT	#SUB	25	  25 	ALA	A	180	 180 	HIS	B	Protein	B	3
FT	#SUB	26	  26 	ASP	A	176	 176 	SER	B	Protein	S	1
FT	#SUB	29	  29 	PRO	A	481	 481 	GLN	B	Protein	S	2
FT	#SUB	30	  30 	SER	A	481	 481 	GLN	B	Protein	B	2
FT	#SUB	31	  31 	ILE	A	479	 479 	THR	B	Protein	A	5
FT	#SUB	31	  31 	ILE	A	481	 481 	GLN	B	Protein	B	3
FT	#SUB	31	  31 	ILE	A	482	 482 	GLU	B	Protein	S	2
FT	#SUB	267	 267 	PRO	A	184	 184 	LEU	B	Protein	S	1
FT	#SUB	312	 312 	SER	A	180	 180 	HIS	B	Protein	S	1
FT	#SUB	313	 313 	TYR	A	177	 177 	PHE	B	Protein	S	10
FT	#SUB	313	 313 	TYR	A	180	 180 	HIS	B	Protein	S	3
FT	#SUB	313	 313 	TYR	A	181	 181 	HIS	B	Protein	A	4
FT	#SUB	315	 315 	THR	A	145	 145 	SER	B	Protein	S	1
FT	#SUB	340	 340 	TYR	A	184	 184 	LEU	B	Protein	S	1
FT	#SUB	390	 390 	LEU	A	140	 140 	GLN	B	Protein	B	2
FT	#SUB	390	 390 	LEU	A	142	 142 	ASN	B	Protein	S	1
FT	#SUB	391	 391 	GLN	A	140	 140 	GLN	B	Protein	B	3
FT	#SUB	392	 392 	ASN	A	140	 140 	GLN	B	Protein	A	6
FT	#SUB	541	 541 	LYS	A	477	 477 	GLY	B	Protein	S	1
FT	#SUB	541	 541 	LYS	A	482	 482 	GLU	B	Protein	S	4
FT	#HET	39	  39 	CYS	A	2	1274 	BME	A	S	4
FT	#HET	248	 248 	LYS	A	1	1273 	BME	A	S	2
FT	#HET	248	 248 	LYS	A	2	1274 	BME	A	A	2
FT	#HET	249	 249 	GLU	A	1	1273 	BME	A	S	1
FT	#HET	251	 251 	SER	A	2	1274 	BME	A	S	1
FT	#HET	252	 252 	GLU	A	1	1273 	BME	A	S	8
FT	#HET	252	 252 	GLU	A	2	1274 	BME	A	S	3
FT	#HET	279	 279 	TRP	A	3	801 	FPF	A	S	2
FT	#HET	290	 290 	SER	A	1	1273 	BME	A	S	1
FT	#HET	294	 294 	LYS	A	1	1273 	BME	A	S	2
FT	#HET	307	 307 	ASP	A	3	801 	FPF	A	S	5
FT	#HET	307	 307 	ASP	A	4	604 	MG	A	S	3
FT	#HET	307	 307 	ASP	A	5	605 	MG	A	S	2
FT	#HET	311	 311 	ASP	A	4	604 	MG	A	S	2
FT	#HET	311	 311 	ASP	A	5	605 	MG	A	S	3
FT	#HET	385	 385 	GLU	A	3	801 	FPF	A	S	1
FT	#HET	385	 385 	GLU	A	5	605 	MG	A	S	3
FT	#HET	448	 448 	ARG	A	3	801 	FPF	A	S	3
FT	#HET	451	 451 	ASP	A	3	801 	FPF	A	S	7
FT	#HET	451	 451 	ASP	A	6	606 	MG	A	S	3
FT	#HET	455	 455 	GLU	A	3	801 	FPF	A	S	5
FT	#HET	455	 455 	GLU	A	6	606 	MG	A	S	3
FT	#HET	526	 526 	LEU	A	3	801 	FPF	A	B	1
FT	#HET	527	 527 	TYR	A	3	801 	FPF	A	S	8
FT	#HET	535	 535 	TYR	A	3	801 	FPF	A	S	10
FT	#HET	536	 536 	VAL	A	3	801 	FPF	A	B	5
FT	DISORDER	1	24
FT	DISORDER	42	44
FT	DISORDER	224	224
FT	DISORDER	459	464
FT	DISORDER	530	534
CC	SEQUENCE	515 AA (ATOM);
CC	ADFQPSIWGD LFLNCPDDAE TEKRHQQLKE EVRKMIVAPM ANSTQKLAFI DSVQRLGVSY
CC	HFTKEIEDEL ENIYHNNNDA ENDLYTTSIR FRLLREHGYN VSCDVFNKFK DEQGNFKSSV
CC	TSDVRGLLEL YQASYLRVHG EDILDEAISF TTHHLSLAVA SLDHPLSEEV SHALKQSIRR
CC	GLPRVEARHY LSVYQDESHN KALLEFAKID FNMLQFLHRK ELSEICRWWK DLDFQRKLPY
CC	ARDRVVEGYF WISGVYFEPQ YSLGRKMLTK VIAMASIVDD TYDSYATYEE LIPYTNAIER
CC	WDIKCIDEIP EYMKPSYKAL LDVYEEMVQL VAEHGRQYRV EYAKNAMIRL AQSYLVEAKW
CC	TLQNYKPSFE EFKANALPTC GYAMLAITSF VGMGDIVTPE TFKWAASDPK IIQASTIICR
CC	FMDDVAEHKF DCSAIECYME EYGVTAQEAY DVFNKHVESA WKDLNQEFLK PTEMPTEVLN
CC	RSLNLARVMD VLYREYVGKA AKGGITSLLI EPIAL
CC	!----
CC	ALIGNMENT OF SEQRES AND ATOMRES
CC	SEQRES MASQVSQMPSSSPLSSNKDEMRPKADFQPSIWGDLFLNCPDKNIDAETEK
CC	ATOM   ------------------------ADFQPSIWGDLFLNCPD---DAETEK
CC	                               *****************   ******
CC	SEQRES RHQQLKEEVRKMIVAPMANSTQKLAFIDSVQRLGVSYHFTKEIEDELENI
CC	ATOM   RHQQLKEEVRKMIVAPMANSTQKLAFIDSVQRLGVSYHFTKEIEDELENI
CC	       **************************************************
CC	SEQRES YHNNNDAENDLYTTSIRFRLLREHGYNVSCDVFNKFKDEQGNFKSSVTSD
CC	ATOM   YHNNNDAENDLYTTSIRFRLLREHGYNVSCDVFNKFKDEQGNFKSSVTSD
CC	       **************************************************
CC	SEQRES VRGLLELYQASYLRVHGEDILDEAISFTTHHLSLAVASLDHPLSEEVSHA
CC	ATOM   VRGLLELYQASYLRVHGEDILDEAISFTTHHLSLAVASLDHPLSEEVSHA
CC	       **************************************************
CC	SEQRES LKQSIRRGLPRVEARHYLSVYQDIESHNKALLEFAKIDFNMLQFLHRKEL
CC	ATOM   LKQSIRRGLPRVEARHYLSVYQD-ESHNKALLEFAKIDFNMLQFLHRKEL
CC	       *********************** **************************
CC	SEQRES SEICRWWKDLDFQRKLPYARDRVVEGYFWISGVYFEPQYSLGRKMLTKVI
CC	ATOM   SEICRWWKDLDFQRKLPYARDRVVEGYFWISGVYFEPQYSLGRKMLTKVI
CC	       **************************************************
CC	SEQRES AMASIVDDTYDSYATYEELIPYTNAIERWDIKCIDEIPEYMKPSYKALLD
CC	ATOM   AMASIVDDTYDSYATYEELIPYTNAIERWDIKCIDEIPEYMKPSYKALLD
CC	       **************************************************
CC	SEQRES VYEEMVQLVAEHGRQYRVEYAKNAMIRLAQSYLVEAKWTLQNYKPSFEEF
CC	ATOM   VYEEMVQLVAEHGRQYRVEYAKNAMIRLAQSYLVEAKWTLQNYKPSFEEF
CC	       **************************************************
CC	SEQRES KANALPTCGYAMLAITSFVGMGDIVTPETFKWAASDPKIIQASTIICRFM
CC	ATOM   KANALPTCGYAMLAITSFVGMGDIVTPETFKWAASDPKIIQASTIICRFM
CC	       **************************************************
CC	SEQRES DDVAEHKFKHRREDDCSAIECYMEEYGVTAQEAYDVFNKHVESAWKDLNQ
CC	ATOM   DDVAEHKF------DCSAIECYMEEYGVTAQEAYDVFNKHVESAWKDLNQ
CC	       ********      ************************************
CC	SEQRES EFLKPTEMPTEVLNRSLNLARVMDVLYREGDGYTYVGKAAKGGITSLLIE
CC	ATOM   EFLKPTEMPTEVLNRSLNLARVMDVLYRE-----YVGKAAKGGITSLLIE
CC	       *****************************     ****************
CC	SEQRES PIAL
CC	ATOM   PIAL
CC	       ****
SQ	SEQUENCE	554 AA;      MW;         CN;
	MASQVSQMPS SSPLSSNKDE MRPKADFQPS IWGDLFLNCP DKNIDAETEK RHQQLKEEVR
	KMIVAPMANS TQKLAFIDSV QRLGVSYHFT KEIEDELENI YHNNNDAEND LYTTSIRFRL
	LREHGYNVSC DVFNKFKDEQ GNFKSSVTSD VRGLLELYQA SYLRVHGEDI LDEAISFTTH
	HLSLAVASLD HPLSEEVSHA LKQSIRRGLP RVEARHYLSV YQDIESHNKA LLEFAKIDFN
	MLQFLHRKEL SEICRWWKDL DFQRKLPYAR DRVVEGYFWI SGVYFEPQYS LGRKMLTKVI
	AMASIVDDTY DSYATYEELI PYTNAIERWD IKCIDEIPEY MKPSYKALLD VYEEMVQLVA
	EHGRQYRVEY AKNAMIRLAQ SYLVEAKWTL QNYKPSFEEF KANALPTCGY AMLAITSFVG
	MGDIVTPETF KWAASDPKII QASTIICRFM DDVAEHKFKH RREDDCSAIE CYMEEYGVTA
	QEAYDVFNKH VESAWKDLNQ EFLKPTEMPT EVLNRSLNLA RVMDVLYREG DGYTYVGKAA
	KGGITSLLIE PIAL
//
ID	3G4FB	STANDARD;	PRT;	554	AA.
DT	CONVERTED FROM PDB (SEQRES) 3G4F
DE	(+)-delta-cadinene synthase isozyme XC1
OS	Gossypium arboreum
CC	EXPDTA	X-RAY DIFFRACTION
CC	RESOLU	2.650
CC	R-Factor	0.206
FT	#SUB	140	 140 	GLN	B	390	 390 	LEU	A	Protein	S	2
FT	#SUB	140	 140 	GLN	B	391	 391 	GLN	A	Protein	S	3
FT	#SUB	140	 140 	GLN	B	392	 392 	ASN	A	Protein	A	6
FT	#SUB	142	 142 	ASN	B	390	 390 	LEU	A	Protein	S	1
FT	#SUB	145	 145 	SER	B	315	 315 	THR	A	Protein	S	1
FT	#SUB	176	 176 	SER	B	25	  25 	ALA	A	Protein	B	2
FT	#SUB	176	 176 	SER	B	26	  26 	ASP	A	Protein	S	1
FT	#SUB	177	 177 	PHE	B	313	 313 	TYR	A	Protein	A	10
FT	#SUB	179	 179 	THR	B	25	  25 	ALA	A	Protein	S	2
FT	#SUB	180	 180 	HIS	B	25	  25 	ALA	A	Protein	A	3
FT	#SUB	180	 180 	HIS	B	312	 312 	SER	A	Protein	S	1
FT	#SUB	180	 180 	HIS	B	313	 313 	TYR	A	Protein	S	3
FT	#SUB	181	 181 	HIS	B	313	 313 	TYR	A	Protein	S	4
FT	#SUB	184	 184 	LEU	B	267	 267 	PRO	A	Protein	S	1
FT	#SUB	184	 184 	LEU	B	340	 340 	TYR	A	Protein	S	1
FT	#SUB	477	 477 	GLY	B	541	 541 	LYS	A	Protein	B	1
FT	#SUB	479	 479 	THR	B	31	  31 	ILE	A	Protein	S	5
FT	#SUB	481	 481 	GLN	B	29	  29 	PRO	A	Protein	S	2
FT	#SUB	481	 481 	GLN	B	30	  30 	SER	A	Protein	S	2
FT	#SUB	481	 481 	GLN	B	31	  31 	ILE	A	Protein	S	3
FT	#SUB	482	 482 	GLU	B	31	  31 	ILE	A	Protein	S	2
FT	#SUB	482	 482 	GLU	B	541	 541 	LYS	A	Protein	S	4
FT	#HET	275	 275 	GLU	B	7	802 	FPF	B	S	1
FT	#HET	279	 279 	TRP	B	7	802 	FPF	B	S	2
FT	#HET	307	 307 	ASP	B	7	802 	FPF	B	S	5
FT	#HET	307	 307 	ASP	B	8	601 	MG	B	S	3
FT	#HET	307	 307 	ASP	B	9	602 	MG	B	S	3
FT	#HET	311	 311 	ASP	B	8	601 	MG	B	S	2
FT	#HET	311	 311 	ASP	B	9	602 	MG	B	S	2
FT	#HET	385	 385 	GLU	B	7	802 	FPF	B	S	1
FT	#HET	385	 385 	GLU	B	9	602 	MG	B	S	2
FT	#HET	448	 448 	ARG	B	7	802 	FPF	B	S	2
FT	#HET	448	 448 	ARG	B	10	603 	MG	B	S	1
FT	#HET	451	 451 	ASP	B	7	802 	FPF	B	S	15
FT	#HET	451	 451 	ASP	B	10	603 	MG	B	S	2
FT	#HET	455	 455 	GLU	B	7	802 	FPF	B	S	8
FT	#HET	455	 455 	GLU	B	10	603 	MG	B	S	3
FT	#HET	526	 526 	LEU	B	7	802 	FPF	B	B	1
FT	#HET	527	 527 	TYR	B	7	802 	FPF	B	S	6
FT	#HET	529	 529 	GLU	B	7	802 	FPF	B	B	1
FT	#HET	535	 535 	TYR	B	7	802 	FPF	B	S	8
FT	#HET	536	 536 	VAL	B	7	802 	FPF	B	B	3
FT	#HET	540	 540 	ALA	B	7	802 	FPF	B	S	1
FT	DISORDER	1	24
FT	DISORDER	42	44
FT	DISORDER	224	224
FT	DISORDER	459	464
FT	DISORDER	530	534
CC	SEQUENCE	515 AA (ATOM);
CC	ADFQPSIWGD LFLNCPDDAE TEKRHQQLKE EVRKMIVAPM ANSTQKLAFI DSVQRLGVSY
CC	HFTKEIEDEL ENIYHNNNDA ENDLYTTSIR FRLLREHGYN VSCDVFNKFK DEQGNFKSSV
CC	TSDVRGLLEL YQASYLRVHG EDILDEAISF TTHHLSLAVA SLDHPLSEEV SHALKQSIRR
CC	GLPRVEARHY LSVYQDESHN KALLEFAKID FNMLQFLHRK ELSEICRWWK DLDFQRKLPY
CC	ARDRVVEGYF WISGVYFEPQ YSLGRKMLTK VIAMASIVDD TYDSYATYEE LIPYTNAIER
CC	WDIKCIDEIP EYMKPSYKAL LDVYEEMVQL VAEHGRQYRV EYAKNAMIRL AQSYLVEAKW
CC	TLQNYKPSFE EFKANALPTC GYAMLAITSF VGMGDIVTPE TFKWAASDPK IIQASTIICR
CC	FMDDVAEHKF DCSAIECYME EYGVTAQEAY DVFNKHVESA WKDLNQEFLK PTEMPTEVLN
CC	RSLNLARVMD VLYREYVGKA AKGGITSLLI EPIAL
CC	!----
CC	ALIGNMENT OF SEQRES AND ATOMRES
CC	SEQRES MASQVSQMPSSSPLSSNKDEMRPKADFQPSIWGDLFLNCPDKNIDAETEK
CC	ATOM   ------------------------ADFQPSIWGDLFLNCPD---DAETEK
CC	                               *****************   ******
CC	SEQRES RHQQLKEEVRKMIVAPMANSTQKLAFIDSVQRLGVSYHFTKEIEDELENI
CC	ATOM   RHQQLKEEVRKMIVAPMANSTQKLAFIDSVQRLGVSYHFTKEIEDELENI
CC	       **************************************************
CC	SEQRES YHNNNDAENDLYTTSIRFRLLREHGYNVSCDVFNKFKDEQGNFKSSVTSD
CC	ATOM   YHNNNDAENDLYTTSIRFRLLREHGYNVSCDVFNKFKDEQGNFKSSVTSD
CC	       **************************************************
CC	SEQRES VRGLLELYQASYLRVHGEDILDEAISFTTHHLSLAVASLDHPLSEEVSHA
CC	ATOM   VRGLLELYQASYLRVHGEDILDEAISFTTHHLSLAVASLDHPLSEEVSHA
CC	       **************************************************
CC	SEQRES LKQSIRRGLPRVEARHYLSVYQDIESHNKALLEFAKIDFNMLQFLHRKEL
CC	ATOM   LKQSIRRGLPRVEARHYLSVYQD-ESHNKALLEFAKIDFNMLQFLHRKEL
CC	       *********************** **************************
CC	SEQRES SEICRWWKDLDFQRKLPYARDRVVEGYFWISGVYFEPQYSLGRKMLTKVI
CC	ATOM   SEICRWWKDLDFQRKLPYARDRVVEGYFWISGVYFEPQYSLGRKMLTKVI
CC	       **************************************************
CC	SEQRES AMASIVDDTYDSYATYEELIPYTNAIERWDIKCIDEIPEYMKPSYKALLD
CC	ATOM   AMASIVDDTYDSYATYEELIPYTNAIERWDIKCIDEIPEYMKPSYKALLD
CC	       **************************************************
CC	SEQRES VYEEMVQLVAEHGRQYRVEYAKNAMIRLAQSYLVEAKWTLQNYKPSFEEF
CC	ATOM   VYEEMVQLVAEHGRQYRVEYAKNAMIRLAQSYLVEAKWTLQNYKPSFEEF
CC	       **************************************************
CC	SEQRES KANALPTCGYAMLAITSFVGMGDIVTPETFKWAASDPKIIQASTIICRFM
CC	ATOM   KANALPTCGYAMLAITSFVGMGDIVTPETFKWAASDPKIIQASTIICRFM
CC	       **************************************************
CC	SEQRES DDVAEHKFKHRREDDCSAIECYMEEYGVTAQEAYDVFNKHVESAWKDLNQ
CC	ATOM   DDVAEHKF------DCSAIECYMEEYGVTAQEAYDVFNKHVESAWKDLNQ
CC	       ********      ************************************
CC	SEQRES EFLKPTEMPTEVLNRSLNLARVMDVLYREGDGYTYVGKAAKGGITSLLIE
CC	ATOM   EFLKPTEMPTEVLNRSLNLARVMDVLYRE-----YVGKAAKGGITSLLIE
CC	       *****************************     ****************
CC	SEQRES PIAL
CC	ATOM   PIAL
CC	       ****
SQ	SEQUENCE	554 AA;      MW;         CN;
	MASQVSQMPS SSPLSSNKDE MRPKADFQPS IWGDLFLNCP DKNIDAETEK RHQQLKEEVR
	KMIVAPMANS TQKLAFIDSV QRLGVSYHFT KEIEDELENI YHNNNDAEND LYTTSIRFRL
	LREHGYNVSC DVFNKFKDEQ GNFKSSVTSD VRGLLELYQA SYLRVHGEDI LDEAISFTTH
	HLSLAVASLD HPLSEEVSHA LKQSIRRGLP RVEARHYLSV YQDIESHNKA LLEFAKIDFN
	MLQFLHRKEL SEICRWWKDL DFQRKLPYAR DRVVEGYFWI SGVYFEPQYS LGRKMLTKVI
	AMASIVDDTY DSYATYEELI PYTNAIERWD IKCIDEIPEY MKPSYKALLD VYEEMVQLVA
	EHGRQYRVEY AKNAMIRLAQ SYLVEAKWTL QNYKPSFEEF KANALPTCGY AMLAITSFVG
	MGDIVTPETF KWAASDPKII QASTIICRFM DDVAEHKFKH RREDDCSAIE CYMEEYGVTA
	QEAYDVFNKH VESAWKDLNQ EFLKPTEMPT EVLNRSLNLA RVMDVLYREG DGYTYVGKAA
	KGGITSLLIE PIAL
//