Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
24550 | 2k3c RC | 15747 | cing | 1-original | 2 | XPLOR/CNS | distance | NOE | ambi |
! --------------------------------------------------------------------------
! Ambiguous NOEs
assign ((resid 1 and name HN))
((resid 4 and name HN) or (resid 3 and name HN))
3.400 1.600 1.600 ! incr to 5.0 after round 10. (54 viol avg 0.274)
assign ((resid 4 and name HA))
((resid 4 and name HB*) or (resid 4 and name HE*))
3.900 2.100 2.100 ! shortened - calc dist 6.377
assign ((resid 4 and name HG*))
((resid 4 and name HB*) or (resid 4 and name HE*))
2.900 1.100 1.100 ! no changes - calc dist 3.370
assign ((resid 4 and name HN))
((resid 4 and name HB*) or (resid 4 and name HE*))
3.900 2.100 2.100 ! shortened - calc dist 8.173
assign ((resid 4 and name HB*) or (resid 18 and name HB*))
((resid 4 and name HG*) or (resid 18 and name HG*))
3.900 2.100 2.100 ! shortened - calc dist 6.725
assign ((resid 4 and name HB*) or (resid 18 and name HB*))
((resid 18 and name HG*))
3.900 2.100 2.100 ! shortened - calc dist 6.337
assign ((resid 4 and name HG*) or (resid 18 and name HG*))
((resid 4 and name HB*) or (resid 18 and name HB*))
3.900 2.100 2.100 ! no changes - calc dist 5.592
assign ((resid 4 and name HB*) or (resid 4 and name HE*))
((resid 1 and name HN))
3.400 1.600 1.600 ! incr to 5.0 after round 8. (64 viol avg 0.237)
assign ((resid 4 and name HB*) or (resid 4 and name HE*))
((resid 1 and name HN))
3.900 2.100 2.100 ! no changes - calc dist 5.152
assign ((resid 4 and name HB*) or (resid 4 and name HE*))
((resid 2 and name HN))
3.400 1.600 1.600 ! incr to 5.0 after round 8. (89 viol avg 0.265)
assign ((resid 4 and name HB*) or (resid 4 and name HE*))
((resid 2 and name HN))
3.400 1.600 1.600 ! incr to 5.0 after round 8. (89 viol avg 0.265)
assign ((resid 4 and name HB*) or (resid 4 and name HE*))
((resid 3 and name HB*))
3.400 1.600 1.600 ! no changes - calc dist 4.128
assign ((resid 4 and name HB*) or (resid 4 and name HE*))
((resid 3 and name HB*))
3.400 1.600 1.600 ! no changes - calc dist 4.993
assign ((resid 4 and name HB*) or (resid 4 and name HE*))
((resid 3 and name HD*))
3.400 1.600 1.600 ! no changes - calc dist 4.285
assign ((resid 4 and name HB*) or (resid 4 and name HE*))
((resid 3 and name HD*))
2.300 0.500 0.500 ! no changes - calc dist 2.143
assign ((resid 4 and name HB*) or (resid 4 and name HE*))
((resid 3 and name HE*))
2.900 1.100 1.100 ! no changes - calc dist 3.937
assign ((resid 4 and name HB*) or (resid 4 and name HE*))
((resid 4 and name HA))
3.900 2.100 2.100 ! no changes - calc dist 5.779
assign ((resid 4 and name HB*) or (resid 4 and name HE*))
((resid 4 and name HA))
3.900 2.100 2.100 ! no changes - calc dist 5.072
assign ((resid 4 and name HB*) or (resid 4 and name HE*))
((resid 4 and name HN))
3.900 2.100 2.100 ! shortened - calc dist 8.199
assign ((resid 4 and name HB*) or (resid 4 and name HE*))
((resid 4 and name HN))
3.900 2.100 2.100 ! shortened - calc dist 8.250
assign ((resid 4 and name HB*) or (resid 4 and name HE*))
((resid 5 and name HB*))
3.900 2.100 2.100 ! shortened - calc dist 6.539
assign ((resid 4 and name HB*) or (resid 4 and name HE*))
((resid 6 and name HN))
3.900 2.100 2.100 ! incr to 6.0 after round 15. (38 viol avg 0.149)
assign ((resid 4 and name HN) or (resid 3 and name HN))
((resid 6 and name HB*))
3.900 2.100 2.100 ! shortened - calc dist 6.404
assign ((resid 5 and name HB*))
((resid 4 and name HB*) or (resid 4 and name HE*))
3.900 2.100 2.100 ! shortened - calc dist 7.282
assign ((resid 6 and name HN))
((resid 4 and name HN) or (resid 3 and name HN))
3.400 1.600 1.600 ! no changes - calc dist 4.927
assign ((resid 15 and name HA))
((resid 18 and name HB*) or (resid 18 and name HE*))
3.900 2.100 2.100 ! no changes - calc dist 5.153
assign ((resid 18 and name HA))
((resid 18 and name HB*) or (resid 18 and name HE*))
3.900 2.100 2.100 ! no changes - calc dist 5.074
assign ((resid 18 and name HA))
((resid 18 and name HB*) or (resid 18 and name HE*))
3.900 2.100 2.100 ! no changes - calc dist 5.253
assign ((resid 18 and name HG*))
((resid 18 and name HB*) or (resid 18 and name HE*))
3.400 1.600 1.600 ! no changes - calc dist 4.087
assign ((resid 18 and name HN))
((resid 18 and name HB*) or (resid 18 and name HE*))
3.400 1.600 1.600 ! no changes - calc dist 4.543
assign ((resid 18 and name HN))
((resid 18 and name HB*) or (resid 18 and name HE*))
3.400 1.600 1.600 ! no changes - calc dist 4.868
assign ((resid 18 and name HB*) or (resid 18 and name HE*))
((resid 18 and name HA))
3.900 2.100 2.100 ! shortened - calc dist 7.888
assign ((resid 18 and name HB*) or (resid 18 and name HE*))
((resid 18 and name HA))
3.900 2.100 2.100 ! shortened - calc dist 7.190
assign ((resid 18 and name HB*) or (resid 18 and name HE*))
((resid 18 and name HN))
3.400 1.600 1.600 ! no changes - calc dist 4.689
assign ((resid 18 and name HB*) or (resid 18 and name HE*))
((resid 18 and name HN))
3.900 2.100 2.100 ! no changes - calc dist 5.482
assign ((resid 18 and name HB*) or (resid 18 and name HE*))
((resid 20 and name HN))
3.400 1.600 1.600 ! incr to 5.0 after round 15. (44 viol avg 0.185)
assign ((resid 18 and name HB*) or (resid 18 and name HE*))
((resid 20 and name HN))
3.400 1.600 1.600 ! incr to 5.0 after round 15. (44 viol avg 0.185)
assign ((resid 19 and name HB*))
((resid 18 and name HB*) or (resid 18 and name HE*))
3.900 2.100 2.100 ! shortened - calc dist 7.058
assign ((resid 21 and name HN) or (resid 24 and name HN))
((resid 23 and name HB*))
3.900 2.100 2.100 ! shortened - calc dist 8.307
assign ((resid 21 and name HN) or (resid 24 and name HN))
((resid 23 and name HN))
3.900 2.100 2.100 ! no changes - calc dist 5.010
assign ((resid 21 and name HN) or (resid 24 and name HN))
((resid 23 and name HB*) or (resid 24 and name HA*) or (resid 23 and name HB*))
3.900 2.100 2.100 ! shortened - calc dist 8.446
assign ((resid 21 and name HA))
((resid 25 and name HN))
3.900 2.100 2.100 ! could be commented out due to major violation after round 14