NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image	mrblock_id	pdb_id	cing	stage	position	program	type	subtype	subsubtype
	11991	1scv	cing	1-original	1	XPLOR/CNS	distance	general distance	simple

set message=off echo=off end
 
! Ca site III
! removed because Ca is attached to D105
!!!!assi (resi 105 and name OD*)   (resi 162 and name CAL) 3.8 2.0 0.8
assi (resi 107 and name OD1)   (resi 162 and name CAL) 3.0 1.2 0.6
assi (resi 109 and name OD*)   (resi 162 and name CAL) 3.8 2.0 0.8
assi (resi 111 and name O)   (resi 162 and name CAL)   3.0 1.2 0.6
! intervening H20 is ligand from D113
!!!assi (resi 113 and name OD*)   (resi 162 and name CAL) 4.0 3.0 2.0
assi (resi 116 and name OE1)   (resi 162 and name CAL) 3.0 1.2 0.6
assi (resi 116 and name OE2)   (resi 162 and name CAL) 3.0 1.2 0.6

! Ca site IV
! removed because Ca is attached to D141
!!!!assi (resi 141 and name OD*)   (resi 163 and name CAL) 3.8 2.0 0.8
assi (resi 143 and name OD1)   (resi 163 and name CAL) 3.0 1.2 0.6
assi (resi 145 and name OD*)   (resi 163 and name CAL) 3.8 2.0 0.8
assi (resi 147 and name O)   (resi 163 and name CAL) 3.0 1.2 0.6
! intervening H20 is ligand from D149
!!!assi (resi 149 and name  )   (resi 163 and name CAL) 3.8 2.0 0.8
assi (resi 152 and name  OE1)   (resi 163 and name CAL) 3.0 1.2 0.6
assi (resi 152 and name  OE2)   (resi 163 and name CAL) 3.0 1.2 0.6

Contact the webmaster for help, if required. Friday, May 3, 2024 11:37:11 PM GMT (wattos1)