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
	22146	2jmd	cing	1-original	2	XPLOR/CNS	distance	general distance	simple

!!!!!!!!!!!!!!!!!!!!site 1
!S-S restraints
assign  (resid 9   and name   SG)  (resid 12  and name   SG)  3.96 0.19 0.19
assign  (resid 9   and name   SG)  (resid 29  and name   SG)  3.96 0.19 0.19
assign  (resid 9   and name   SG)  (resid 32  and name   SG)  3.96 0.19 0.19

assign  (resid 12  and name   SG)  (resid 29  and name   SG)  3.96 0.19 0.19
assign  (resid 12  and name   SG)  (resid 32  and name   SG)  3.96 0.19 0.19

assign  (resid 29  and name   SG)  (resid 32  and name   SG)  3.96 0.19 0.19


! ZN -S restraints
assign  (id 975)  (resid 9   and name   SG)  2.33  0.05 0.05
assign  (id 975)  (resid 12  and name   SG)  2.33  0.05 0.05
assign  (id 975)  (resid 29  and name   SG)  2.33  0.05 0.05
assign  (id 975)  (resid 32  and name   SG)  2.33  0.05 0.05

! Zn CB restraints
assign  (id 975)  (resid 9   and name   CB)  3.43  0.18  0.18
assign  (id 975)  (resid 12  and name   CB)  3.43  0.18  0.18
assign  (id 975)  (resid 29  and name   CB)  3.43  0.18  0.18
assign  (id 975)  (resid 32  and name   CB)  3.43  0.18  0.18

!!!!!!!!!!!!!!!!!!!!site 2

!CYS24
assign  (resid 24   and name   SG)  (resid 44  and name   SG)  3.96 0.19 0.19


! ZN restraints
assign   (id 976)  (resid 24   and name  SG)  2.33  0.05 0.05
assign   (id 976)  (resid 44  and name   SG)  2.33  0.05 0.05
assign   (id 976)  (resid 26  and name   ND1)  2.04  0.4 0.4
     or  (id 976)  (resid 26  and name   NE2)

! Zn CB restraints
assign  (id 976)  (resid 24   and name  CB)  3.43  0.18  0.18
assign  (id 976)  (resid 44  and name   CB)  3.43  0.18  0.18

! Zn - ASP restraints
assign  (id 976)  (resid 47 and name  OD1)  2.02  0.1  0.1
     or (id 976)  (resid 47 and name  OD2) 

Contact the webmaster for help, if required. Monday, April 29, 2024 11:04:17 AM GMT (wattos1)