;CT-HMQC-J with water flip-back and composite proton 180-degree pulse. ;3J(HnHa) from set of J-modulated CT-HMQC spectra. ;Andy C. Wang and Ad Bax, November 1995. ;Kuboniwa, Grzesiek, Delaglio, Bax, J. Biomol. NMR, 4, (1994), 871-878. ;BMRB Pulse Sequence Accession Number: 27 ;_______________________________________________________________________________ #include "bits.sg" #define NITROGEN ;_______________________________________________________________________________ ;PROTON: ;p1 proton 90-degree pulse at hl1=3 dB ;p2 water flip-back pulse at hl1=3 dB ;NITROGEN: ;p7 high power N15 90-degree pulse on f3 ;p31 low power N15 90-degree pulse (190us) on f3 at dbl0 ;nitrogen incrementation ;in20=in21=1/(4sw) ;DELAYS: ;d7=de d8=aq d11=50m d12=10m d13=p1*2.11+2u ;d20= 1/4 of HN->HA transfer time d21=d20 ;_______________________________________________________________________________ 100u RESET ; ze 2 d11 d12 3 d12*4 4 10u dbo do ;***** presaturation ***** 10u d1 hl1 dbhi dlo 12.5m HIGH(11) ;lock off (p1 ph1):f1 2u GRAD( 20, POSITIV, 20) 4.35m ;***** HMQC to N (p7 ph2):f3 d13 2u GRAD( 30, POSITIV, 10.0) d20 (p7*2 ph8):f3 2u GRAD( 40, POSITIV, 10.0) d21 p7*0.636:c8 (p1 ph0 2u p1*2.22 ph3 2u p1 ph0):f1 ;composite 180-degree pulse p7*0.636:c8 GRAD( 50, POSITIV, 10.0) 2u d21 (p7*2 ph10):f3 2u GRAD( 60, POSITIV, 10.0) d20 d13 (p7 ph4):f3 2u GRAD( 70, POSITIV, 20) 4.35m (p1 ph5):f1 2u GRAD( 80, POSITIV, 12) 2m dblo dbl0 (p1 ph6):f1 90u (p2 ph7):f1 ;water flip-back pulse go=2 ph31 cpdb 1m LOW(11) ;lock on 1m dbo d11 wr #0 if #0 zd d12 ip2 lo to 3 times 2 d12 id21 d12 dd20 d12 ip31 d12 ip31 lo to 4 times l3 do dbo exit ph0=0 ph1=0 2 ph2=0 0 2 2 ph3=1 ph4=0 ph5=2 0 ph6=0 0 0 0 1 1 1 1 2 2 2 2 3 3 3 3 ph7=(360)180 180 180 180 270 270 270 270 0 0 0 0 90 90 90 90 ph8=PHASE_16(0) PHASE_16(2) ph10=0 ph31=0 0 2 2 1 1 3 3 2 2 0 0 3 3 1 1