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

24711 2k4a cing 1-original 1 HADDOCK distance NOE ambi
!
! HADDOCK AIR restraints for 1st molecule
!
!
assign ( resid 48  and segid A)
       (
        ( resid 21  and segid B)
     or
        ( resid 23  and segid B)
     or
        ( resid 27  and segid B)
     or
        ( resid 28  and segid B)
     or
        ( resid 30  and segid B)
     or
        ( resid 31  and segid B)
     or
        ( resid 32  and segid B)
     or
        ( resid 105  and segid B)
     or
        ( resid 107  and segid B)
     or
        ( resid 111  and segid B)
     or
        ( resid 114  and segid B)
     or
        ( resid 22  and segid B)
     or
        ( resid 24  and segid B)
     or
        ( resid 25  and segid B)
     or
        ( resid 26  and segid B)
     or
        ( resid 104  and segid B)
     or
        ( resid 106  and segid B)
     or
        ( resid 108  and segid B)
     or
        ( resid 110  and segid B)
     or
        ( resid 112  and segid B)
       )  3.0 3.0 0.0
!
assign ( resid 49  and segid A)
       (
        ( resid 21  and segid B)
     or
        ( resid 23  and segid B)
     or
        ( resid 27  and segid B)
     or
        ( resid 28  and segid B)
     or
        ( resid 30  and segid B)
     or
        ( resid 31  and segid B)
     or
        ( resid 32  and segid B)
     or
        ( resid 105  and segid B)
     or
        ( resid 107  and segid B)
     or
        ( resid 111  and segid B)
     or
        ( resid 114  and segid B)
     or
        ( resid 22  and segid B)
     or
        ( resid 24  and segid B)
     or
        ( resid 25  and segid B)
     or
        ( resid 26  and segid B)
     or
        ( resid 104  and segid B)
     or
        ( resid 106  and segid B)
     or
        ( resid 108  and segid B)
     or
        ( resid 110  and segid B)
     or
        ( resid 112  and segid B)
       )  3.0 3.0 0.0
!
assign ( resid 50  and segid A)
       (
        ( resid 21  and segid B)
     or
        ( resid 23  and segid B)
     or
        ( resid 27  and segid B)
     or
        ( resid 28  and segid B)
     or
        ( resid 30  and segid B)
     or
        ( resid 31  and segid B)
     or
        ( resid 32  and segid B)
     or
        ( resid 105  and segid B)
     or
        ( resid 107  and segid B)
     or
        ( resid 111  and segid B)
     or
        ( resid 114  and segid B)
     or
        ( resid 22  and segid B)
     or
        ( resid 24  and segid B)
     or
        ( resid 25  and segid B)
     or
        ( resid 26  and segid B)
     or
        ( resid 104  and segid B)
     or
        ( resid 106  and segid B)
     or
        ( resid 108  and segid B)
     or
        ( resid 110  and segid B)
     or
        ( resid 112  and segid B)
       )  3.0 3.0 0.0
!
assign ( resid 82  and segid A)
       (
        ( resid 21  and segid B)
     or
        ( resid 23  and segid B)
     or
        ( resid 27  and segid B)
     or
        ( resid 28  and segid B)
     or
        ( resid 30  and segid B)
     or
        ( resid 31  and segid B)
     or
        ( resid 32  and segid B)
     or
        ( resid 105  and segid B)
     or
        ( resid 107  and segid B)
     or
        ( resid 111  and segid B)
     or
        ( resid 114  and segid B)
     or
        ( resid 22  and segid B)
     or
        ( resid 24  and segid B)
     or
        ( resid 25  and segid B)
     or
        ( resid 26  and segid B)
     or
        ( resid 104  and segid B)
     or
        ( resid 106  and segid B)
     or
        ( resid 108  and segid B)
     or
        ( resid 110  and segid B)
     or
        ( resid 112  and segid B)
       )  3.0 3.0 0.0
!
assign ( resid 84  and segid A)
       (
        ( resid 21  and segid B)
     or
        ( resid 23  and segid B)
     or
        ( resid 27  and segid B)
     or
        ( resid 28  and segid B)
     or
        ( resid 30  and segid B)
     or
        ( resid 31  and segid B)
     or
        ( resid 32  and segid B)
     or
        ( resid 105  and segid B)
     or
        ( resid 107  and segid B)
     or
        ( resid 111  and segid B)
     or
        ( resid 114  and segid B)
     or
        ( resid 22  and segid B)
     or
        ( resid 24  and segid B)
     or
        ( resid 25  and segid B)
     or
        ( resid 26  and segid B)
     or
        ( resid 104  and segid B)
     or
        ( resid 106  and segid B)
     or
        ( resid 108  and segid B)
     or
        ( resid 110  and segid B)
     or
        ( resid 112  and segid B)
       )  3.0 3.0 0.0
!
assign ( resid 105  and segid A)
       (
        ( resid 21  and segid B)
     or
        ( resid 23  and segid B)
     or
        ( resid 27  and segid B)
     or
        ( resid 28  and segid B)
     or
        ( resid 30  and segid B)
     or
        ( resid 31  and segid B)
     or
        ( resid 32  and segid B)
     or
        ( resid 105  and segid B)
     or
        ( resid 107  and segid B)
     or
        ( resid 111  and segid B)
     or
        ( resid 114  and segid B)
     or
        ( resid 22  and segid B)
     or
        ( resid 24  and segid B)
     or
        ( resid 25  and segid B)
     or
        ( resid 26  and segid B)
     or
        ( resid 104  and segid B)
     or
        ( resid 106  and segid B)
     or
        ( resid 108  and segid B)
     or
        ( resid 110  and segid B)
     or
        ( resid 112  and segid B)
       )  3.0 3.0 0.0
!
assign ( resid 109  and segid A)
       (
        ( resid 21  and segid B)
     or
        ( resid 23  and segid B)
     or
        ( resid 27  and segid B)
     or
        ( resid 28  and segid B)
     or
        ( resid 30  and segid B)
     or
        ( resid 31  and segid B)
     or
        ( resid 32  and segid B)
     or
        ( resid 105  and segid B)
     or
        ( resid 107  and segid B)
     or
        ( resid 111  and segid B)
     or
        ( resid 114  and segid B)
     or
        ( resid 22  and segid B)
     or
        ( resid 24  and segid B)
     or
        ( resid 25  and segid B)
     or
        ( resid 26  and segid B)
     or
        ( resid 104  and segid B)
     or
        ( resid 106  and segid B)
     or
        ( resid 108  and segid B)
     or
        ( resid 110  and segid B)
     or
        ( resid 112  and segid B)
       )  3.0 3.0 0.0
!
assign ( resid 110  and segid A)
       (
        ( resid 21  and segid B)
     or
        ( resid 23  and segid B)
     or
        ( resid 27  and segid B)
     or
        ( resid 28  and segid B)
     or
        ( resid 30  and segid B)
     or
        ( resid 31  and segid B)
     or
        ( resid 32  and segid B)
     or
        ( resid 105  and segid B)
     or
        ( resid 107  and segid B)
     or
        ( resid 111  and segid B)
     or
        ( resid 114  and segid B)
     or
        ( resid 22  and segid B)
     or
        ( resid 24  and segid B)
     or
        ( resid 25  and segid B)
     or
        ( resid 26  and segid B)
     or
        ( resid 104  and segid B)
     or
        ( resid 106  and segid B)
     or
        ( resid 108  and segid B)
     or
        ( resid 110  and segid B)
     or
        ( resid 112  and segid B)
       )  3.0 3.0 0.0
!
assign ( resid 127  and segid A)
       (
        ( resid 21  and segid B)
     or
        ( resid 23  and segid B)
     or
        ( resid 27  and segid B)
     or
        ( resid 28  and segid B)
     or
        ( resid 30  and segid B)
     or
        ( resid 31  and segid B)
     or
        ( resid 32  and segid B)
     or
        ( resid 105  and segid B)
     or
        ( resid 107  and segid B)
     or
        ( resid 111  and segid B)
     or
        ( resid 114  and segid B)
     or
        ( resid 22  and segid B)
     or
        ( resid 24  and segid B)
     or
        ( resid 25  and segid B)
     or
        ( resid 26  and segid B)
     or
        ( resid 104  and segid B)
     or
        ( resid 106  and segid B)
     or
        ( resid 108  and segid B)
     or
        ( resid 110  and segid B)
     or
        ( resid 112  and segid B)
       )  3.0 3.0 0.0
!
! HADDOCK AIR restraints for 2nd molecule
!
!
assign ( resid 21  and segid B)
       (
        ( resid 48  and segid A)
     or
        ( resid 49  and segid A)
     or
        ( resid 50  and segid A)
     or
        ( resid 82  and segid A)
     or
        ( resid 84  and segid A)
     or
        ( resid 105  and segid A)
     or
        ( resid 109  and segid A)
     or
        ( resid 110  and segid A)
     or
        ( resid 127  and segid A)
     or
        ( resid 83  and segid A)
     or
        ( resid 103  and segid A)
     or
        ( resid 104  and segid A)
     or
        ( resid 106  and segid A)
     or
        ( resid 107  and segid A)
     or
        ( resid 108  and segid A)
     or
        ( resid 125  and segid A)
     or
        ( resid 126  and segid A)
       )  3.0 3.0 0.0
!
assign ( resid 23  and segid B)
       (
        ( resid 48  and segid A)
     or
        ( resid 49  and segid A)
     or
        ( resid 50  and segid A)
     or
        ( resid 82  and segid A)
     or
        ( resid 84  and segid A)
     or
        ( resid 105  and segid A)
     or
        ( resid 109  and segid A)
     or
        ( resid 110  and segid A)
     or
        ( resid 127  and segid A)
     or
        ( resid 83  and segid A)
     or
        ( resid 103  and segid A)
     or
        ( resid 104  and segid A)
     or
        ( resid 106  and segid A)
     or
        ( resid 107  and segid A)
     or
        ( resid 108  and segid A)
     or
        ( resid 125  and segid A)
     or
        ( resid 126  and segid A)
       )  3.0 3.0 0.0
!
assign ( resid 27  and segid B)
       (
        ( resid 48  and segid A)
     or
        ( resid 49  and segid A)
     or
        ( resid 50  and segid A)
     or
        ( resid 82  and segid A)
     or
        ( resid 84  and segid A)
     or
        ( resid 105  and segid A)
     or
        ( resid 109  and segid A)
     or
        ( resid 110  and segid A)
     or
        ( resid 127  and segid A)
     or
        ( resid 83  and segid A)
     or
        ( resid 103  and segid A)
     or
        ( resid 104  and segid A)
     or
        ( resid 106  and segid A)
     or
        ( resid 107  and segid A)
     or
        ( resid 108  and segid A)
     or
        ( resid 125  and segid A)
     or
        ( resid 126  and segid A)
       )  3.0 3.0 0.0
!
assign ( resid 28  and segid B)
       (
        ( resid 48  and segid A)
     or
        ( resid 49  and segid A)
     or
        ( resid 50  and segid A)
     or
        ( resid 82  and segid A)
     or
        ( resid 84  and segid A)
     or
        ( resid 105  and segid A)
     or
        ( resid 109  and segid A)
     or
        ( resid 110  and segid A)
     or
        ( resid 127  and segid A)
     or
        ( resid 83  and segid A)
     or
        ( resid 103  and segid A)
     or
        ( resid 104  and segid A)
     or
        ( resid 106  and segid A)
     or
        ( resid 107  and segid A)
     or
        ( resid 108  and segid A)
     or
        ( resid 125  and segid A)
     or
        ( resid 126  and segid A)
       )  3.0 3.0 0.0
!
assign ( resid 30  and segid B)
       (
        ( resid 48  and segid A)
     or
        ( resid 49  and segid A)
     or
        ( resid 50  and segid A)
     or
        ( resid 82  and segid A)
     or
        ( resid 84  and segid A)
     or
        ( resid 105  and segid A)
     or
        ( resid 109  and segid A)
     or
        ( resid 110  and segid A)
     or
        ( resid 127  and segid A)
     or
        ( resid 83  and segid A)
     or
        ( resid 103  and segid A)
     or
        ( resid 104  and segid A)
     or
        ( resid 106  and segid A)
     or
        ( resid 107  and segid A)
     or
        ( resid 108  and segid A)
     or
        ( resid 125  and segid A)
     or
        ( resid 126  and segid A)
       )  3.0 3.0 0.0
!
assign ( resid 31  and segid B)
       (
        ( resid 48  and segid A)
     or
        ( resid 49  and segid A)
     or
        ( resid 50  and segid A)
     or
        ( resid 82  and segid A)
     or
        ( resid 84  and segid A)
     or
        ( resid 105  and segid A)
     or
        ( resid 109  and segid A)
     or
        ( resid 110  and segid A)
     or
        ( resid 127  and segid A)
     or
        ( resid 83  and segid A)
     or
        ( resid 103  and segid A)
     or
        ( resid 104  and segid A)
     or
        ( resid 106  and segid A)
     or
        ( resid 107  and segid A)
     or
        ( resid 108  and segid A)
     or
        ( resid 125  and segid A)
     or
        ( resid 126  and segid A)
       )  3.0 3.0 0.0
!
assign ( resid 32  and segid B)
       (
        ( resid 48  and segid A)
     or
        ( resid 49  and segid A)
     or
        ( resid 50  and segid A)
     or
        ( resid 82  and segid A)
     or
        ( resid 84  and segid A)
     or
        ( resid 105  and segid A)
     or
        ( resid 109  and segid A)
     or
        ( resid 110  and segid A)
     or
        ( resid 127  and segid A)
     or
        ( resid 83  and segid A)
     or
        ( resid 103  and segid A)
     or
        ( resid 104  and segid A)
     or
        ( resid 106  and segid A)
     or
        ( resid 107  and segid A)
     or
        ( resid 108  and segid A)
     or
        ( resid 125  and segid A)
     or
        ( resid 126  and segid A)
       )  3.0 3.0 0.0
!
assign ( resid 105  and segid B)
       (
        ( resid 48  and segid A)
     or
        ( resid 49  and segid A)
     or
        ( resid 50  and segid A)
     or
        ( resid 82  and segid A)
     or
        ( resid 84  and segid A)
     or
        ( resid 105  and segid A)
     or
        ( resid 109  and segid A)
     or
        ( resid 110  and segid A)
     or
        ( resid 127  and segid A)
     or
        ( resid 83  and segid A)
     or
        ( resid 103  and segid A)
     or
        ( resid 104  and segid A)
     or
        ( resid 106  and segid A)
     or
        ( resid 107  and segid A)
     or
        ( resid 108  and segid A)
     or
        ( resid 125  and segid A)
     or
        ( resid 126  and segid A)
       )  3.0 3.0 0.0
!
assign ( resid 107  and segid B)
       (
        ( resid 48  and segid A)
     or
        ( resid 49  and segid A)
     or
        ( resid 50  and segid A)
     or
        ( resid 82  and segid A)
     or
        ( resid 84  and segid A)
     or
        ( resid 105  and segid A)
     or
        ( resid 109  and segid A)
     or
        ( resid 110  and segid A)
     or
        ( resid 127  and segid A)
     or
        ( resid 83  and segid A)
     or
        ( resid 103  and segid A)
     or
        ( resid 104  and segid A)
     or
        ( resid 106  and segid A)
     or
        ( resid 107  and segid A)
     or
        ( resid 108  and segid A)
     or
        ( resid 125  and segid A)
     or
        ( resid 126  and segid A)
       )  3.0 3.0 0.0
!
assign ( resid 111  and segid B)
       (
        ( resid 48  and segid A)
     or
        ( resid 49  and segid A)
     or
        ( resid 50  and segid A)
     or
        ( resid 82  and segid A)
     or
        ( resid 84  and segid A)
     or
        ( resid 105  and segid A)
     or
        ( resid 109  and segid A)
     or
        ( resid 110  and segid A)
     or
        ( resid 127  and segid A)
     or
        ( resid 83  and segid A)
     or
        ( resid 103  and segid A)
     or
        ( resid 104  and segid A)
     or
        ( resid 106  and segid A)
     or
        ( resid 107  and segid A)
     or
        ( resid 108  and segid A)
     or
        ( resid 125  and segid A)
     or
        ( resid 126  and segid A)
       )  3.0 3.0 0.0
!
assign ( resid 114  and segid B)
       (
        ( resid 48  and segid A)
     or
        ( resid 49  and segid A)
     or
        ( resid 50  and segid A)
     or
        ( resid 82  and segid A)
     or
        ( resid 84  and segid A)
     or
        ( resid 105  and segid A)
     or
        ( resid 109  and segid A)
     or
        ( resid 110  and segid A)
     or
        ( resid 127  and segid A)
     or
        ( resid 83  and segid A)
     or
        ( resid 103  and segid A)
     or
        ( resid 104  and segid A)
     or
        ( resid 106  and segid A)
     or
        ( resid 107  and segid A)
     or
        ( resid 108  and segid A)
     or
        ( resid 125  and segid A)
     or
        ( resid 126  and segid A)
       )  3.0 3.0 0.0
!
! HADDOCK AIR restraints for 3rd molecule
!
!
! HADDOCK AIR restraints for 4th molecule
!
!
! HADDOCK AIR restraints for 5th molecule
!
!
! HADDOCK AIR restraints for 6th molecule
!
Please acknowledge these references in publications where the data from this site have been utilized.
Contact the webmaster for help, if required. Sunday, May 5, 2024 10:03:33 AM GMT (wattos1)
image	mrblock_id	pdb_id	cing	stage	position	program	type	subtype	subsubtype
	24711	2k4a	cing	1-original	1	HADDOCK	distance	NOE	ambi