# 1 "/opt/topspin2.0/exp/stan/nmr/lists/pp/hsqct2etf3gpsi3d" ;hsqct2etf3gpsi3d ;avance-version (04/01/05) ;3D H-1/X correlation via double inept transfer ; using sensitivity improvement ;for measuring N-15 T2 relaxation times ;phase sensitive using Echo/Antiecho-TPPI gradient selection ;with decoupling during acquisition ;using f3 - channel ;using flip-back pulse ;as pseudo3D ;(use parameterset HSQCT2ETF3GPSI3D) ; ;$CLASS=HighRes ;$DIM=3D ;$TYPE= ;$SUBTYPE= ;$COMMENT= ;$OWNER=Bruker prosol relations= # 1 "/opt/topspin2.0/exp/stan/nmr/lists/pp/Avance.incl" 1 ;Avance2.incl ; for 1 ; ;avance-version (06/02/20) ; ;$CLASS=HighRes Incl ;$COMMENT= ;$Id: Avance2.incl,v 1.14.4.1 2006/11/10 11:02:26 ber Exp $ # 24 "/opt/topspin2.0/exp/stan/nmr/lists/pp/hsqct2etf3gpsi3d" 2 # 1 "/opt/topspin2.0/exp/stan/nmr/lists/pp/Grad.incl" 1 ;Grad2.incl - include file for Gradient Spectroscopy ; for 1 ; ;avance-version (06/12/04) ; ;$CLASS=HighRes Incl ;$COMMENT= define list EA= ;$Id: Grad2.incl,v 1.8.2.2 2006/12/04 11:32:22 ber Exp $ # 25 "/opt/topspin2.0/exp/stan/nmr/lists/pp/hsqct2etf3gpsi3d" 2 # 1 "/opt/topspin2.0/exp/stan/nmr/lists/pp/Delay.incl" 1 ;Delay.incl - include file for commonly used delays ; ;version 00/02/07 ; ;$CLASS=HighRes Incl ;$COMMENT= ;general delays define delay DELTA define delay DELTA1 define delay DELTA2 define delay DELTA3 define delay DELTA4 define delay DELTA5 define delay DELTA6 define delay DELTA7 define delay DELTA8 define delay TAU define delay TAU1 define delay TAU2 define delay TAU3 define delay TAU4 define delay TAU5 ;delays for centering pulses define delay CEN_HN1 define delay CEN_HN2 define delay CEN_HN3 define delay CEN_HC1 define delay CEN_HC2 define delay CEN_HC3 define delay CEN_HC4 define delay CEN_HP1 define delay CEN_HP2 define delay CEN_CN1 define delay CEN_CN2 define delay CEN_CN3 define delay CEN_CN4 define delay CEN_CP1 define delay CEN_CP2 ;loop counters define loopcounter COUNTER define loopcounter SCALEF define loopcounter FACTOR1 define loopcounter FACTOR2 define loopcounter FACTOR3 ;$Id: Delay.incl,v 1.12 2005/11/10 12:16:58 ber Exp $ # 26 "/opt/topspin2.0/exp/stan/nmr/lists/pp/hsqct2etf3gpsi3d" 2 "p2=p1*2" "p22=p21*2" "d10=3u" "d11=30m" "d12=20u" "d24=1s/(cnst4*cnst11)" "d25=1s/(cnst4*cnst12)" "d26=1s/(cnst4*4)" "d21=450u" "d31=(p30*16+d21*32)" "DELTA2=p16+d16+8u" "DELTA3=d21-p2/2" "DELTA4=d25-p16-d16" "DELTA1=d25-p16-d16-p2-d10*2-p21*4/3.1415" "spoff1=0" "spoff13=bf2*((cnst21+cnst22)/2000000)-o2" aqseq 312 # 1 "mc_line 63 file /opt/topspin2.0/exp/stan/nmr/lists/pp/hsqct2etf3gpsi3d expanding definition part of mc command before ze" define delay MCWRK define delay MCREST "MCWRK = d1" "MCREST = d1 - d1" dccorr # 63 "/opt/topspin2.0/exp/stan/nmr/lists/pp/hsqct2etf3gpsi3d" 1 ze # 1 "mc_line 63 file /opt/topspin2.0/exp/stan/nmr/lists/pp/hsqct2etf3gpsi3d expanding definition of mc command after ze" # 64 "/opt/topspin2.0/exp/stan/nmr/lists/pp/hsqct2etf3gpsi3d" d11 pl16:f3 st0 2 6m do:f3 3 3m 4 d11 # 1 "mc_line 68 file /opt/topspin2.0/exp/stan/nmr/lists/pp/hsqct2etf3gpsi3d expanding start label for mc command" 5 MCWRK LBLF1, MCREST # 69 "/opt/topspin2.0/exp/stan/nmr/lists/pp/hsqct2etf3gpsi3d" (p1 ph1) d26 pl3:f3 (center (p2 ph1) (p22 ph1):f3 ) d26 setnmr3|0 setnmr0|34|32|33 ctrlgrad 0 (p1 ph2) 4u pl0:f1 (p11:sp1 ph1:r):f1 4u p16:gp1 d16 pl1:f1 (p21 ph3):f3 d25 (center (p2 ph1) (p22 ph6):f3 ) d25 pl23:f3 6 d21 (p30 ph6 d21*2 p30 ph6 d21*2 p30 ph6 d21*2 p30 ph6):f3 DELTA3 (p2 ph1) DELTA3 (p30 ph6 d21*2 p30 ph6 d21*2 p30 ph6 d21*2 p30 ph6):f3 d21*2 (p30 ph6 d21*2 p30 ph6 d21*2 p30 ph6 d21*2 p30 ph6):f3 DELTA3 (p2 ph8) DELTA3 (p30 ph6 d21*2 p30 ph6 d21*2 p30 ph6 d21*2 p30 ph6):f3 d21 lo to 6 times c p16:gp2*-1*EA d16 DELTA4 pl3:f3 (p22 ph6):f3 d10 (p2 ph7) d10 p16:gp2*EA d16 DELTA1 (center (p1 ph1) (p21 ph4):f3 ) d24 (center (p2 ph1) (p22 ph1):f3 ) d24 (center (p1 ph2) (p21 ph5):f3 ) d26 (center (p2 ph1) (p22 ph1):f3 ) d26 (p1 ph1) DELTA2 (p2 ph1) 4u p16:gp3 d16 pl16:f3 4u setnmr3^0 setnmr0^34^32^33 ctrlgrad 7 goscnp ph31 cpd3:f3 3m do:f3 3m st ivc lo to 3 times nbl 3m ipp3 ipp4 ipp5 ipp6 ipp7 ipp31 lo to 4 times ns # 1 "mc_line 143 file /opt/topspin2.0/exp/stan/nmr/lists/pp/hsqct2etf3gpsi3d expanding mc command in line" MCWRK wr #0 if #0 zd lo to LBLF1 times td1 # 146 "/opt/topspin2.0/exp/stan/nmr/lists/pp/hsqct2etf3gpsi3d" d31 exit ph0=0 ph1=0 ph2=1 ph3=0 2 ph4=0 0 2 2 ph5=3 3 1 1 ph6=0 0 0 0 2 2 2 2 ph7=0 0 2 2 ph8=2 ph31=0 2 2 0 ;pl0 : 120dB ;pl1 : f1 channel - power level for pulse (default) ;pl3 : f3 channel - power level for pulse (default) ;pl16: f3 channel - power level for CPD/BB decoupling ;pl23: f3 channel - power level for TOCSY-spinlock ;sp1 : f1 channel - shaped pulse 90 degree ;sp13: f2 channel - shaped pulse 180 degree (Ca and C=O, adiabatic) ;p1 : f1 channel - 90 degree high power pulse ;p2 : f1 channel - 180 degree high power pulse ;p8 : f2 channel - 180 degree shaped pulse for inversion (adiabatic) ;p11: f1 channel - 90 degree shaped pulse ;p16: homospoil/gradient pulse ;p21: f3 channel - 90 degree high power pulse ;p22: f3 channel - 180 degree high power pulse ;p30: f3 channel - 180 degree pulse at pl23 ;d1 : relaxation delay; 1-5 * T1 ;d10 : incremented delay [3 usec] ;d11: delay for disk I/O [30 msec] ;d12: delay for power switching [20 usec] ;d16: delay for homospoil/gradient recovery ;d21: echo delay [450 usec] ;d24: 1/(4J)YH for YH ; 1/(8J)YH for all multiplicities ;d25: 1/(4J)YH for YH ; 1/(8J)YH for all multiplicities ;d26: 1/(4J(YH)) ;d31: length of single cpmg loop ;cnst4: = J(YH) ;cnst11: for multiplicity selection = 4 for NH, 8 for all multiplicities ;cnst12: for multiplicity selection = 4 for NH, 8 for all multiplicities ;cnst21: CO chemical shift (offset, in ppm) ;cnst22: Calpha chemical shift (offset, in ppm) ;vc : variable loop-coounter for T2 delay, taken from vc-list ;in10: 1/(2 * SW(X)) = DW(X) ;nd10: 2 ;NS: 2 * n ;DS: >= 16 ;td1: number of delays in vc-list ;td2: number of experiments in F2 ;NBL: = td1 ;FnMODE: QF in F1 ;FnMODE: echo-antiecho in F2 ;cpd3: decoupling according to sequence defined by cpdprg3 ;pcpd3: f3 channel - 90 degree pulse for decoupling sequence ;use gradient ratio: gp 1 : gp 2 : gp 3 ; 30 : 80 : 16.2 for N-15 ;for z-only gradients: ;gpz1: 30% ;gpz2: 80% ;gpz3: 16.2% ;use gradient files: ;gpnam1: SINE.100 ;gpnam2: SINE.100 ;gpnam3: SINE.100 ;preprocessor-flags-start ;LABEL_CN: for C-13 and N-15 labeled samples start experiment with ; option -DLABEL_CN (eda: ZGOPTNS) ;preprocessor-flags-end ;$Id: hsqct2etf3gpsi3d,v 1.3 2005/11/10 12:17:00 ber Exp $