NMR Restraints Grid

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

image	mrblock_id	pdb_id	cing	in_recoord	in_dress	stage	position	program	type	subtype	subsubtype
	3924	1ef5	cing	recoord	dress	1-original	2	XPLOR/CNS	distance	hydrogen bond	simple

! alpha helix constraints
!
assign (resid  678 and name HN   )(resid  674 and name O    ) 2.3 0.8 0.2
assign (resid  678 and name N    )(resid  674 and name O    ) 3.3 0.8 0.2
assign (resid  679 and name HN   )(resid  675 and name O    ) 2.3 0.8 0.2
assign (resid  679 and name N    )(resid  675 and name O    ) 3.3 0.8 0.2
assign (resid  680 and name HN   )(resid  676 and name O    ) 2.3 0.8 0.2
assign (resid  680 and name N    )(resid  676 and name O    ) 3.3 0.8 0.2
assign (resid  681 and name HN   )(resid  677 and name O    ) 2.3 0.8 0.2
assign (resid  681 and name N    )(resid  677 and name O    ) 3.3 0.8 0.2
assign (resid  682 and name HN   )(resid  678 and name O    ) 2.3 0.8 0.2
assign (resid  682 and name N    )(resid  678 and name O    ) 3.3 0.8 0.2
assign (resid  683 and name HN   )(resid  679 and name O    ) 2.3 0.8 0.2
assign (resid  683 and name N    )(resid  679 and name O    ) 3.3 0.8 0.2
assign (resid  684 and name HN   )(resid  680 and name O    ) 2.3 0.8 0.2
assign (resid  684 and name N    )(resid  680 and name O    ) 3.3 0.8 0.2
!
! beta sheet constraints
!
! sheet1 <-> sheet2  Anti-parallel
assign (resid  652 and name HN   )(resid  667 and name O    ) 2.3 0.8 0.2
assign (resid  652 and name N    )(resid  667 and name O    ) 3.3 0.8 0.2
assign (resid  667 and name HN   )(resid  652 and name O    ) 2.3 0.8 0.2
assign (resid  667 and name N    )(resid  652 and name O    ) 3.3 0.8 0.2
assign (resid  654 and name HN   )(resid  665 and name O    ) 2.3 0.8 0.2
assign (resid  654 and name N    )(resid  665 and name O    ) 3.3 0.8 0.2
assign (resid  665 and name HN   )(resid  654 and name O    ) 2.3 0.8 0.2
assign (resid  665 and name N    )(resid  654 and name O    ) 3.3 0.8 0.2
! sheet3 <-> sheet4  Anti-parallel
assign (resid  700 and name HN   )(resid  708 and name O    ) 2.3 0.8 0.2
assign (resid  700 and name N    )(resid  708 and name O    ) 3.3 0.8 0.2
assign (resid  708 and name HN   )(resid  700 and name O    ) 2.3 0.8 0.2
assign (resid  708 and name N    )(resid  700 and name O    ) 3.3 0.8 0.2
! sheet3 <-> sheet5  Anti-parallel
assign (resid  697 and name HN   )(resid  731 and name O    ) 2.3 0.8 0.2
assign (resid  697 and name N    )(resid  731 and name O    ) 3.3 0.8 0.2
assign (resid  731 and name HN   )(resid  697 and name O    ) 2.3 0.8 0.2
assign (resid  731 and name N    )(resid  697 and name O    ) 3.3 0.8 0.2
assign (resid  699 and name HN   )(resid  729 and name O    ) 2.3 0.8 0.2
assign (resid  699 and name N    )(resid  729 and name O    ) 3.3 0.8 0.2
assign (resid  729 and name HN   )(resid  699 and name O    ) 2.3 0.8 0.2
assign (resid  729 and name N    )(resid  699 and name O    ) 3.3 0.8 0.2
! sheet1 <-> sheet5  Parallel
assign (resid  726 and name HN   )(resid  651 and name O    ) 2.3 0.8 0.2
assign (resid  726 and name N    )(resid  651 and name O    ) 3.3 0.8 0.2
assign (resid  653 and name HN   )(resid  726 and name O    ) 2.3 0.8 0.2
assign (resid  653 and name N    )(resid  726 and name O    ) 3.3 0.8 0.2
assign (resid  728 and name HN   )(resid  653 and name O    ) 2.3 0.8 0.2
assign (resid  728 and name N    )(resid  653 and name O    ) 3.3 0.8 0.2
assign (resid  655 and name HN   )(resid  728 and name O    ) 2.3 0.8 0.2
assign (resid  655 and name N    )(resid  728 and name O    ) 3.3 0.8 0.2
!!

Contact the webmaster for help, if required. Monday, April 29, 2024 12:38:35 AM GMT (wattos1)