NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
1213 |
1acz   |
cing | 1-original | 6 | XPLOR/CNS | distance | NOE | ambi |
!multi.tbl
!for SBD/bCD complex
!for ambiguous NOEs
!
assign (resid 519 and name hd#)
((resid 537 and name hd#) or (resid 540 and name hd#)) 5.00 3.10 0.80 !540_d 1
assign (resid 519 and name he#)
((resid 537 and name hd#) or (resid 540 and name hd#)) 5.00 3.10 0.80 !540_d,ol 1
assign (resid 519 and name hz)
((resid 537 and name hd#) or (resid 540 and name hd#)) 5.00 3.10 0.80 !540_d,ol 1
assign (resid 531 and name hd#)
((resid 531 and name ha) or (resid 524 and name ha)) 5.00 3.10 0.80 ! 1
assign (resid 531 and name hd#)
((resid 581 and name ha) or (resid 582 and name ha)) 3.00 1.10 0.50 ! 3
assign (resid 532 and name hd#)
((resid 580 and name hd#) or (resid 582 and name hd#)) 2.60 0.70 0.40 !ol 4
assign (resid 536 and name hn)
((resid 537 and name hd#) or (resid 540 and name hd#)) 3.60 1.70 0.80 !540_d,ol 2
assign (resid 564 and name hd#)
((resid 551 and name ha) or (resid 555 and name ha)) 3.00 1.10 0.50 ! 3
assign (resid 564 and name he#)
((resid 551 and name ha) or (resid 555 and name ha)) 3.00 1.10 0.50 ! 3
assign (resid 544 and name hn)
((resid 534 and name ha) or (resid 547 and name ha)) 5.00 3.10 0.80 ! 1
assign (resid 590 and name hd1)
((resid 543 and name hb#) or (resid 592 and name hb#)) 5.00 3.10 0.80 !ol 1
assign (resid 615 and name hd1)
((resid 531 and name ha) or (resid 614 and name ha)) 5.00 3.10 0.80 !ol 1
assign (resid 598 and name he#)
((resid 515 and name ha) or (resid 612 and name hb)) 5.00 3.10 0.80 !ol 1
!inter1.tbl
!intermolecular NOEs between SBD and bCD
!BCD1 for site 1, BCD2 for site 2
!
!SITE 1-------------------------------------------
!
assign (resid 543 and name hd1 )
((segid BCD1 and resid 1 and name H5) or
(segid BCD1 and resid 2 and name H5) or
(segid BCD1 and resid 3 and name H5) or
(segid BCD1 and resid 4 and name H5) or
(segid BCD1 and resid 5 and name H5) or
(segid BCD1 and resid 6 and name H5) or
(segid BCD1 and resid 7 and name H5) or
(segid BCD1 and resid 1 and name H61) or
(segid BCD1 and resid 2 and name H61) or
(segid BCD1 and resid 3 and name H61) or
(segid BCD1 and resid 4 and name H61) or
(segid BCD1 and resid 5 and name H61) or
(segid BCD1 and resid 6 and name H61) or
(segid BCD1 and resid 7 and name H61) or
(segid BCD1 and resid 1 and name H62) or
(segid BCD1 and resid 2 and name H62) or
(segid BCD1 and resid 3 and name H62) or
(segid BCD1 and resid 4 and name H62) or
(segid BCD1 and resid 5 and name H62) or
(segid BCD1 and resid 6 and name H62) or
(segid BCD1 and resid 7 and name H62)) 2.40 0.50 0.30 ! 5
assign (resid 543 and name hd1 )
((segid BCD1 and resid 1 and name H3) or
(segid BCD1 and resid 2 and name H3) or
(segid BCD1 and resid 3 and name H3) or
(segid BCD1 and resid 4 and name H3) or
(segid BCD1 and resid 5 and name H3) or
(segid BCD1 and resid 6 and name H3) or
(segid BCD1 and resid 7 and name H3)) 2.40 0.50 0.30 ! 5
assign (resid 543 and name he1 )
((segid BCD1 and resid 1 and name H5) or
(segid BCD1 and resid 2 and name H5) or
(segid BCD1 and resid 3 and name H5) or
(segid BCD1 and resid 4 and name H5) or
(segid BCD1 and resid 5 and name H5) or
(segid BCD1 and resid 6 and name H5) or
(segid BCD1 and resid 7 and name H5) or
(segid BCD1 and resid 1 and name H61) or
(segid BCD1 and resid 2 and name H61) or
(segid BCD1 and resid 3 and name H61) or
(segid BCD1 and resid 4 and name H61) or
(segid BCD1 and resid 5 and name H61) or
(segid BCD1 and resid 6 and name H61) or
(segid BCD1 and resid 7 and name H61) or
(segid BCD1 and resid 1 and name H62) or
(segid BCD1 and resid 2 and name H62) or
(segid BCD1 and resid 3 and name H62) or
(segid BCD1 and resid 4 and name H62) or
(segid BCD1 and resid 5 and name H62) or
(segid BCD1 and resid 6 and name H62) or
(segid BCD1 and resid 7 and name H62)) 5.00 3.10 0.80 ! 1
assign (resid 543 and name he1 )
((segid BCD1 and resid 1 and name H3) or
(segid BCD1 and resid 2 and name H3) or
(segid BCD1 and resid 3 and name H3) or
(segid BCD1 and resid 4 and name H3) or
(segid BCD1 and resid 5 and name H3) or
(segid BCD1 and resid 6 and name H3) or
(segid BCD1 and resid 7 and name H3)) 5.00 3.10 0.80 ! 1
assign (resid 590 and name he1 )
((segid BCD1 and resid 1 and name H5) or
(segid BCD1 and resid 2 and name H5) or
(segid BCD1 and resid 3 and name H5) or
(segid BCD1 and resid 4 and name H5) or
(segid BCD1 and resid 5 and name H5) or
(segid BCD1 and resid 6 and name H5) or
(segid BCD1 and resid 7 and name H5) or
(segid BCD1 and resid 1 and name H61) or
(segid BCD1 and resid 2 and name H61) or
(segid BCD1 and resid 3 and name H61) or
(segid BCD1 and resid 4 and name H61) or
(segid BCD1 and resid 5 and name H61) or
(segid BCD1 and resid 6 and name H61) or
(segid BCD1 and resid 7 and name H61) or
(segid BCD1 and resid 1 and name H62) or
(segid BCD1 and resid 2 and name H62) or
(segid BCD1 and resid 3 and name H62) or
(segid BCD1 and resid 4 and name H62) or
(segid BCD1 and resid 5 and name H62) or
(segid BCD1 and resid 6 and name H62) or
(segid BCD1 and resid 7 and name H62)) 3.00 1.10 0.50 ! 3
assign (resid 590 and name he1 ) (segid BCD1 and resid 1 and name H3) 3.60 1.70 0.80 ! 2
! ((segid BCD1 and resid 1 and name H3) or
! (segid BCD1 and resid 2 and name H3) or
! (segid BCD1 and resid 3 and name H3) or
! (segid BCD1 and resid 4 and name H3) or
! (segid BCD1 and resid 5 and name H3) or
! (segid BCD1 and resid 6 and name H3) or
! (segid BCD1 and resid 7 and name H3)) 3.60 1.70 0.80 ! 2
!
!SITE 2---------------------------------------------------------------
!
assign (resid 523 and name hn )
((segid BCD2 and resid 1 and name H2) or
(segid BCD2 and resid 2 and name H2) or
(segid BCD2 and resid 3 and name H2) or
(segid BCD2 and resid 4 and name H2) or
(segid BCD2 and resid 5 and name H2) or
(segid BCD2 and resid 6 and name H2) or
(segid BCD2 and resid 7 and name H2)) 5.00 3.10 0.80 ! 1
assign (resid 523 and name hn )
((segid BCD2 and resid 1 and name H3) or
(segid BCD2 and resid 2 and name H3) or
(segid BCD2 and resid 3 and name H3) or
(segid BCD2 and resid 4 and name H3) or
(segid BCD2 and resid 5 and name H3) or
(segid BCD2 and resid 6 and name H3) or
(segid BCD2 and resid 7 and name H3)) 5.00 3.10 0.80 ! 1
assign (resid 526 and name hn )
((segid BCD2 and resid 1 and name H5) or
(segid BCD2 and resid 2 and name H5) or
(segid BCD2 and resid 3 and name H5) or
(segid BCD2 and resid 4 and name H5) or
(segid BCD2 and resid 5 and name H5) or
(segid BCD2 and resid 6 and name H5) or
(segid BCD2 and resid 7 and name H5) or
(segid BCD2 and resid 1 and name H61) or
(segid BCD2 and resid 2 and name H61) or
(segid BCD2 and resid 3 and name H61) or
(segid BCD2 and resid 4 and name H61) or
(segid BCD2 and resid 5 and name H61) or
(segid BCD2 and resid 6 and name H61) or
(segid BCD2 and resid 7 and name H61) or
(segid BCD2 and resid 1 and name H62) or
(segid BCD2 and resid 2 and name H62) or
(segid BCD2 and resid 3 and name H62) or
(segid BCD2 and resid 4 and name H62) or
(segid BCD2 and resid 5 and name H62) or
(segid BCD2 and resid 6 and name H62) or
(segid BCD2 and resid 7 and name H62)) 5.00 3.10 0.80 ! 1
assign (resid 527 and name hn )
((segid BCD2 and resid 1 and name H5) or
(segid BCD2 and resid 2 and name H5) or
(segid BCD2 and resid 3 and name H5) or
(segid BCD2 and resid 4 and name H5) or
(segid BCD2 and resid 5 and name H5) or
(segid BCD2 and resid 6 and name H5) or
(segid BCD2 and resid 7 and name H5) or
(segid BCD2 and resid 1 and name H61) or
(segid BCD2 and resid 2 and name H61) or
(segid BCD2 and resid 3 and name H61) or
(segid BCD2 and resid 4 and name H61) or
(segid BCD2 and resid 5 and name H61) or
(segid BCD2 and resid 6 and name H61) or
(segid BCD2 and resid 7 and name H61) or
(segid BCD2 and resid 1 and name H62) or
(segid BCD2 and resid 2 and name H62) or
(segid BCD2 and resid 3 and name H62) or
(segid BCD2 and resid 4 and name H62) or
(segid BCD2 and resid 5 and name H62) or
(segid BCD2 and resid 6 and name H62) or
(segid BCD2 and resid 7 and name H62)) 3.00 1.10 0.50 ! 3
assign (resid 527 and name hb# )
((segid BCD2 and resid 1 and name H5) or
(segid BCD2 and resid 2 and name H5) or
(segid BCD2 and resid 3 and name H5) or
(segid BCD2 and resid 4 and name H5) or
(segid BCD2 and resid 5 and name H5) or
(segid BCD2 and resid 6 and name H5) or
(segid BCD2 and resid 7 and name H5) or
(segid BCD2 and resid 1 and name H61) or
(segid BCD2 and resid 2 and name H61) or
(segid BCD2 and resid 3 and name H61) or
(segid BCD2 and resid 4 and name H61) or
(segid BCD2 and resid 5 and name H61) or
(segid BCD2 and resid 6 and name H61) or
(segid BCD2 and resid 7 and name H61) or
(segid BCD2 and resid 1 and name H62) or
(segid BCD2 and resid 2 and name H62) or
(segid BCD2 and resid 3 and name H62) or
(segid BCD2 and resid 4 and name H62) or
(segid BCD2 and resid 5 and name H62) or
(segid BCD2 and resid 6 and name H62) or
(segid BCD2 and resid 7 and name H62)) 5.00 3.10 0.80 ! 1 (check SS of beta later)
assign (resid 527 and name hd# )
((segid BCD2 and resid 1 and name H5) or
(segid BCD2 and resid 2 and name H5) or
(segid BCD2 and resid 3 and name H5) or
(segid BCD2 and resid 4 and name H5) or
(segid BCD2 and resid 5 and name H5) or
(segid BCD2 and resid 6 and name H5) or
(segid BCD2 and resid 7 and name H5) or
(segid BCD2 and resid 1 and name H61) or
(segid BCD2 and resid 2 and name H61) or
(segid BCD2 and resid 3 and name H61) or
(segid BCD2 and resid 4 and name H61) or
(segid BCD2 and resid 5 and name H61) or
(segid BCD2 and resid 6 and name H61) or
(segid BCD2 and resid 7 and name H61) or
(segid BCD2 and resid 1 and name H62) or
(segid BCD2 and resid 2 and name H62) or
(segid BCD2 and resid 3 and name H62) or
(segid BCD2 and resid 4 and name H62) or
(segid BCD2 and resid 5 and name H62) or
(segid BCD2 and resid 6 and name H62) or
(segid BCD2 and resid 7 and name H62)) 2.40 0.50 0.30 ! 5
assign (resid 527 and name hd# )
((segid BCD2 and resid 1 and name H3) or
(segid BCD2 and resid 2 and name H3) or
(segid BCD2 and resid 3 and name H3) or
(segid BCD2 and resid 4 and name H3) or
(segid BCD2 and resid 5 and name H3) or
(segid BCD2 and resid 6 and name H3) or
(segid BCD2 and resid 7 and name H3)) 2.40 0.50 0.30 ! 5
assign (resid 527 and name he# )
((segid BCD2 and resid 1 and name H5) or
(segid BCD2 and resid 2 and name H5) or
(segid BCD2 and resid 3 and name H5) or
(segid BCD2 and resid 4 and name H5) or
(segid BCD2 and resid 5 and name H5) or
(segid BCD2 and resid 6 and name H5) or
(segid BCD2 and resid 7 and name H5) or
(segid BCD2 and resid 1 and name H61) or
(segid BCD2 and resid 2 and name H61) or
(segid BCD2 and resid 3 and name H61) or
(segid BCD2 and resid 4 and name H61) or
(segid BCD2 and resid 5 and name H61) or
(segid BCD2 and resid 6 and name H61) or
(segid BCD2 and resid 7 and name H61) or
(segid BCD2 and resid 1 and name H62) or
(segid BCD2 and resid 2 and name H62) or
(segid BCD2 and resid 3 and name H62) or
(segid BCD2 and resid 4 and name H62) or
(segid BCD2 and resid 5 and name H62) or
(segid BCD2 and resid 6 and name H62) or
(segid BCD2 and resid 7 and name H62)) 2.40 0.50 0.30 ! 5
assign (resid 527 and name he# )
((segid BCD2 and resid 1 and name H3) or
(segid BCD2 and resid 2 and name H3) or
(segid BCD2 and resid 3 and name H3) or
(segid BCD2 and resid 4 and name H3) or
(segid BCD2 and resid 5 and name H3) or
(segid BCD2 and resid 6 and name H3) or
(segid BCD2 and resid 7 and name H3)) 2.40 0.50 0.30 ! 5
assign (resid 553 and name hb# )
((segid BCD2 and resid 1 and name H5) or
(segid BCD2 and resid 2 and name H5) or
(segid BCD2 and resid 3 and name H5) or
(segid BCD2 and resid 4 and name H5) or
(segid BCD2 and resid 5 and name H5) or
(segid BCD2 and resid 6 and name H5) or
(segid BCD2 and resid 7 and name H5) or
(segid BCD2 and resid 1 and name H61) or
(segid BCD2 and resid 2 and name H61) or
(segid BCD2 and resid 3 and name H61) or
(segid BCD2 and resid 4 and name H61) or
(segid BCD2 and resid 5 and name H61) or
(segid BCD2 and resid 6 and name H61) or
(segid BCD2 and resid 7 and name H61) or
(segid BCD2 and resid 1 and name H62) or
(segid BCD2 and resid 2 and name H62) or
(segid BCD2 and resid 3 and name H62) or
(segid BCD2 and resid 4 and name H62) or
(segid BCD2 and resid 5 and name H62) or
(segid BCD2 and resid 6 and name H62) or
(segid BCD2 and resid 7 and name H62)) 2.60 0.70 0.40 !poss_ol_red_by_1 4
assign (resid 553 and name hb# ) (segid BCD2 and resid 1 and name H3) 2.60 0.70 0.40 ! 4
! ((segid BCD2 and resid 1 and name H3) or
! (segid BCD2 and resid 2 and name H3) or
! (segid BCD2 and resid 3 and name H3) or
! (segid BCD2 and resid 4 and name H3) or
! (segid BCD2 and resid 5 and name H3) or
! (segid BCD2 and resid 6 and name H3) or
! (segid BCD2 and resid 7 and name H3)) 2.60 0.70 0.40 ! 4
assign (resid 556 and name hd# )
((segid BCD2 and resid 1 and name H5) or
(segid BCD2 and resid 2 and name H5) or
(segid BCD2 and resid 3 and name H5) or
(segid BCD2 and resid 4 and name H5) or
(segid BCD2 and resid 5 and name H5) or
(segid BCD2 and resid 6 and name H5) or
(segid BCD2 and resid 7 and name H5) or
(segid BCD2 and resid 1 and name H61) or
(segid BCD2 and resid 2 and name H61) or
(segid BCD2 and resid 3 and name H61) or
(segid BCD2 and resid 4 and name H61) or
(segid BCD2 and resid 5 and name H61) or
(segid BCD2 and resid 6 and name H61) or
(segid BCD2 and resid 7 and name H61) or
(segid BCD2 and resid 1 and name H62) or
(segid BCD2 and resid 2 and name H62) or
(segid BCD2 and resid 3 and name H62) or
(segid BCD2 and resid 4 and name H62) or
(segid BCD2 and resid 5 and name H62) or
(segid BCD2 and resid 6 and name H62) or
(segid BCD2 and resid 7 and name H62)) 3.00 1.10 0.50 ! 3
assign (resid 556 and name hd# )
((segid BCD2 and resid 1 and name H3) or
(segid BCD2 and resid 2 and name H3) or
(segid BCD2 and resid 3 and name H3) or
(segid BCD2 and resid 4 and name H3) or
(segid BCD2 and resid 5 and name H3) or
(segid BCD2 and resid 6 and name H3) or
(segid BCD2 and resid 7 and name H3)) 5.00 3.10 0.80 ! 1
assign (resid 556 and name he# )
((segid BCD2 and resid 1 and name H5) or
(segid BCD2 and resid 2 and name H5) or
(segid BCD2 and resid 3 and name H5) or
(segid BCD2 and resid 4 and name H5) or
(segid BCD2 and resid 5 and name H5) or
(segid BCD2 and resid 6 and name H5) or
(segid BCD2 and resid 7 and name H5) or
(segid BCD2 and resid 1 and name H61) or
(segid BCD2 and resid 2 and name H61) or
(segid BCD2 and resid 3 and name H61) or
(segid BCD2 and resid 4 and name H61) or
(segid BCD2 and resid 5 and name H61) or
(segid BCD2 and resid 6 and name H61) or
(segid BCD2 and resid 7 and name H61) or
(segid BCD2 and resid 1 and name H62) or
(segid BCD2 and resid 2 and name H62) or
(segid BCD2 and resid 3 and name H62) or
(segid BCD2 and resid 4 and name H62) or
(segid BCD2 and resid 5 and name H62) or
(segid BCD2 and resid 6 and name H62) or
(segid BCD2 and resid 7 and name H62)) 2.60 0.70 0.40 !ol 4
assign (resid 556 and name he# )
((segid BCD2 and resid 1 and name H3) or
(segid BCD2 and resid 2 and name H3) or
(segid BCD2 and resid 3 and name H3) or
(segid BCD2 and resid 4 and name H3) or
(segid BCD2 and resid 5 and name H3) or
(segid BCD2 and resid 6 and name H3) or
(segid BCD2 and resid 7 and name H3)) 2.60 0.70 0.40 !ol 4
assign (resid 562 and name hg )
((segid BCD2 and resid 1 and name H1) or
(segid BCD2 and resid 2 and name H1) or
(segid BCD2 and resid 3 and name H1) or
(segid BCD2 and resid 4 and name H1) or
(segid BCD2 and resid 5 and name H1) or
(segid BCD2 and resid 6 and name H1) or
(segid BCD2 and resid 7 and name H1)) 3.00 1.10 0.50 ! 3
!
Contact the webmaster for help, if required. Tuesday, April 16, 2024 10:56:34 AM GMT (wattos1)