NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
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3896 |
1edp   |
2262 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | simple |
remarks NOE classification: KEY remarks key noe constraints (108 entries) remarks distance constraints are XPLOR format remarks TABLE OF INTERPROTON DISTANCES remarks lst value is equ. value, 2nd value is error on - side remarks 3rd value is error on + side set echo=false end set wrnlev=0 end assign (resid 10 and name HN )(resid 11 and name HN ) 2.78 0.29 0.15 assign (resid 11 and name HN )(resid 12 and name HN ) 2.83 0.15 0.20 assign (resid 12 and name HN )(resid 13 and name HN ) 2.88 0.18 0.16 assign (resid 13 and name HN )(resid 14 and name HN ) 2.95 0.20 0.24 assign (resid 14 and name HN )(resid 15 and name HN ) 2.84 0.18 0.20 assign (resid 11 and name HA )(resid 12 and name HN ) 3.35 0.25 0.28 assign (resid 12 and name HA )(resid 15 and name HN ) 3.50 0.25 0.30 assign (resid 9 and name HA )(resid 12 and name HB ) 2.50 0.12 0.25 assign (resid 9 and name HA )(resid 12 and name HN ) 3.25 0.40 0.45 assign (resid 6 and name HA )(resid 9 and name HN ) 4.30 0.75 5.10 assign (resid 14 and name HN )(resid 12 and name HA ) 4.10 0.60 0.80 assign (resid 11 and name HN )(resid 8 and name HB* ) 4.20 1.20 3.10 assign (resid 10 and name HA )(resid 13 and name HB* ) 3.30 0.40 0.35 assign (resid 2 and name HA )(resid 5 and name HB* ) 3.80 0.50 9.00 assign (resid 3 and name HA )(resid 6 and name HB* ) 3.80 0.50 9.00 assign (resid 4 and name HA )(resid 7 and name HB* ) 3.60 0.35 9.00 assign (resid 5 and name HA )(resid 8 and name HB* ) 3.60 0.35 9.00 assign (resid 6 and name HA )(resid 9 and name HB* ) 3.80 0.50 6.00 assign (resid 7 and name HA )(resid 10 and name HB* ) 4.05 0.45 9.00 assign (resid 1 and name HA )(resid 2 and name HN ) 2.20 0.20 0.36 assign (resid 10 and name HA )(resid 13 and name HN ) 3.50 0.22 0.25 assign (resid 12 and name HA )(resid 12 and name HB ) 3.02 0.22 0.08 assign (resid 13 and name HD* )(resid 14 and name HN ) 2.95 0.25 0.65 assign (resid 12 and name HA )(resid 17 and name HN ) 3.52 0.29 0.30 assign (resid 12 and name HA )(resid 16 and name HN ) 4.00 0.38 3.10 assign (resid 8 and name HB* )(resid 9 and name HN ) 3.60 0.30 3.10 assign (resid 7 and name HB* )(resid 8 and name HN ) 2.60 0.45 0.40 assign (resid 7 and name HN )(resid 8 and name HN ) 2.82 0.23 0.34 assign (resid 8 and name HN )(resid 9 and name HN ) 3.45 0.10 0.95 assign (resid 5 and name HB* )(resid 7 and name HN ) 3.35 0.30 0.85 remarks short.tbl assign (resid 6 and name HN )(resid 7 and name HN ) 3.15 0.15 0.65 assign (resid 15 and name HA )(resid 16 and name HN ) 3.45 0.15 0.35 assign (resid 3 and name HA )(resid 4 and name HN ) 2.75 0.30 0.25 assign (resid 12 and name HA )(resid 13 and name HN ) 3.55 0.15 0.20 assign (resid 5 and name HA )(resid 6 and name HN ) 2.60 0.29 0.30 assign (resid 12 and name HB )(resid 13 and name HN ) 2.85 0.30 0.20 assign (resid 9 and name HA )(resid 10 and name HN ) 3.40 0.20 0.30 assign (resid 9 and name HA )(resid 12 and name HN ) 3.50 0.25 0.25 assign (resid 15 and name HN )(resid 16 and name HN ) 2.80 0.30 0.25 assign (resid 12 and name HA )(resid 15 and name HB* ) 3.80 0.40 2.55 assign (resid 7 and name HN )(resid 6 and name HB* ) 3.35 0.28 3.20 assign (resid 16 and name HA )(resid 19 and name HB ) 3.90 0.60 9.00 assign (resid 5 and name HN )(resid 6 and name HN ) 3.60 0.20 0.75 assign (resid 9 and name HN )(resid 10 and name HN ) 2.95 0.28 0.45 assign (resid 13 and name HA )(resid 14 and name HN ) 3.35 0.35 0.25 assign (resid 9 and name HA )(resid 13 and name HN ) 4.20 0.55 1.30 assign (resid 14 and name HN )(resid 10 and name HA ) 3.90 0.35 1.20 assign (resid 15 and name HN )(resid 15 and name HB* ) 2.68 0.28 0.38 assign (resid 11 and name HN )(resid 10 and name HB* ) 3.00 0.60 0.50 assign (resid 10 and name HA )(resid 13 and name HD* ) 3.25 0.35 0.50 assign (resid 17 and name HN )(resid 12 and name HB ) 4.05 0.65 1.25 assign (resid 11 and name HA )(resid 14 and name HN ) 3.40 0.25 1.40 assign (resid 11 and name HA )(resid 13 and name HB* ) 3.80 0.40 5.00 assign (resid 7 and name HA )(resid 10 and name HN ) 4.00 0.60 3.10 assign (resid 9 and name HA )(resid 11 and name HN ) 4.00 0.45 4.10 assign (resid 14 and name HA )(resid 16 and name HN ) 4.00 0.65 3.10 assign (resid 15 and name HA )(resid 18 and name HB* ) 4.10 0.60 5.10 assign (resid 14 and name HA )(resid 17 and name HN ) 4.00 0.65 3.10 assign (resid 13 and name HA )(resid 16 and name HN ) 3.60 0.25 0.28 assign (resid 15 and name HA )(resid 18 and name HN ) 4.10 0.65 4.10 assign (resid 14 and name HB* )(resid 15 and name HN ) 3.00 0.70 0.20 assign (resid 13 and name HB* )(resid 14 and name HN ) 2.80 0.70 0.20 assign (resid 15 and name HN )(resid 14 and name HD* ) 3.50 0.40 0.75 assign (resid 14 and name HA )(resid 15 and name HN ) 3.25 0.30 0.33 assign (resid 11 and name HA )(resid 12 and name HN ) 3.20 0.20 0.27 assign (resid 6 and name HA )(resid 7 and name HN ) 3.15 0.35 0.30 assign (resid 16 and name HA )(resid 17 and name HN ) 2.90 0.30 0.25 assign (resid 5 and name HN )(resid 3 and name HB* ) 3.49 0.25 1.55 assign (resid 3 and name HB* )(resid 3 and name HN ) 2.80 0.30 0.65 remarks keyMe.tbl assign (resid 3 and name HN )(resid 6 and name HD* ) 3.40 0.30 0.60 assign (resid 6 and name HA )(resid 12 and name HG2* ) 2.75 0.20 0.65 assign (resid 6 and name HN )(resid 12 and name HG2* ) 4.00 0.30 5.10 assign (resid 6 and name HN )(resid 12 and name HG1* ) 3.80 0.35 5.10 assign (resid 9 and name HA )(resid 12 and name HG2* ) 2.75 0.22 0.50 assign (resid 9 and name HN )(resid 12 and name HG1* ) 4.00 0.35 5.00 assign (resid 9 and name HN )(resid 12 and name HG2* ) 4.00 0.35 5.10 assign (resid 12 and name HN )(resid 12 and name HG2* ) 2.65 0.25 0.20 assign (resid 12 and name HA )(resid 12 and name HG1* ) 2.78 0.25 0.65 assign (resid 12 and name HA )(resid 12 and name HG2* ) 2.42 0.25 0.45 assign (resid 16 and name HN )(resid 12 and name HG2* ) 3.80 0.30 6.00 assign (resid 13 and name HN )(resid 12 and name HG1* ) 3.20 0.30 0.45 assign (resid 13 and name HN )(resid 12 and name HG2* ) 3.45 0.45 0.80 remarks keylb.tbl assign (resid 16 and name HD2 )(resid 12 and name HG2* ) 4.00 0.60 6.00 assign (resid 16 and name HD2 )(resid 12 and name HG1* ) 3.00 0.30 3.10 assign (resid 13 and name HA )(resid 12 and name HG2* ) 4.00 0.80 3.10 assign (resid 14 and name HB* )(resid 17 and name HD* ) 4.00 1.10 9.00 assign (resid 15 and name HB* )(resid 17 and name HN ) 4.00 1.10 9.00 assign (resid 1 and name HB* )(resid 14 and name HD* ) 4.00 1.20 9.00 assign (resid 1 and name HB* )(resid 14 and name HE* ) 4.00 1.20 9.00 assign (resid 5 and name HN )(resid 6 and name HD* ) 4.00 0.95 6.00 assign (resid 16 and name HE1 )(resid 12 and name HG2* ) 4.00 0.60 9.00 assign (resid 1 and name HA )(resid 17 and name HA ) 4.00 1.15 9.00 assign (resid 1 and name HA )(resid 14 and name HD* ) 4.00 1.20 9.00 assign (resid 1 and name HA )(resid 14 and name HE* ) 4.00 1.20 9.00 assign (resid 2 and name HB* )(resid 16 and name HD2 ) 4.00 1.00 9.00 assign (resid 2 and name HB* )(resid 12 and name HG2* ) 4.00 1.00 9.00 assign (resid 2 and name HN )(resid 17 and name HA ) 4.00 0.90 9.00 assign (resid 3 and name HA )(resid 18 and name HB* ) 4.00 1.25 9.00 assign (resid 3 and name HB1 )(resid 6 and name HD* ) 4.00 1.00 9.00 assign (resid 3 and name HB2 )(resid 6 and name HD* ) 4.00 1.00 9.00 assign (resid 3 and name HB1 )(resid 12 and name HG2* ) 4.00 1.00 9.00 assign (resid 3 and name HB2 )(resid 12 and name HG2* ) 4.00 1.00 9.00 assign (resid 3 and name HB* )(resid 5 and name HN ) 3.90 1.05 3.10 assign (resid 16 and name HN )(resid 13 and name HB* ) 3.20 0.20 5.00 assign (resid 17 and name HN )(resid 13 and name HB* ) 3.25 0.20 5.00 assign (resid 15 and name HB* )(resid 16 and name HN ) 3.30 0.45 3.10 remarks long assign (resid 11 and name HB* )(resid 5 and name HN ) 3.30 0.20 0.60 assign (resid 9 and name HE* )(resid 7 and name HA ) 3.80 0.65 0.65 remarks end of key noe distance constraints remarks NOE classification: SECONDRAY remarks other less well-determined sequential connectivities assign (resid 8 and name HA )(resid 9 and name HN ) 2.40 0.30 0.35 assign (resid 3 and name HB* )(resid 3 and name HN ) 2.60 0.35 0.25 assign (resid 8 and name HB* )(resid 9 and name HN ) 4.00 0.28 3.10 assign (resid 7 and name HB* )(resid 8 and name HN ) 2.45 0.30 0.25 assign (resid 8 and name HB* )(resid 11 and name HN ) 3.60 0.50 0.60 assign (resid 5 and name HA )(resid 7 and name HN ) 4.00 0.85 3.10 assign (resid 10 and name HA )(resid 12 and name HN ) 3.80 0.35 3.10 remarks only distinct at pH = 5.8 assign (resid 5 and name HB* )(resid 8 and name HN ) 3.10 0.20 0.65 remarks Me.tbl assign (resid 6 and name HA )(resid 6 and name HD* ) 2.50 0.25 0.45 assign (resid 6 and name HA )(resid 12 and name HG1* ) 4.00 0.50 4.00 assign (resid 9 and name HA )(resid 12 and name HG1* ) 3.50 0.20 0.90 assign (resid 10 and name HN )(resid 12 and name HG1* ) 4.00 0.35 5.10 assign (resid 10 and name HN )(resid 12 and name HG2* ) 4.00 0.35 5.60 assign (resid 14 and name HA )(resid 12 and name HG2* ) 3.80 0.35 5.10 assign (resid 13 and name HA )(resid 12 and name HG2* ) 3.65 0.30 3.10 assign (resid 13 and name HA )(resid 12 and name HG1* ) 3.40 0.80 5.10 assign (resid 12 and name HN )(resid 12 and name HG1* ) 3.65 0.40 0.55 assign (resid 6 and name HN )(resid 6 and name HD* ) 3.45 0.55 0.65 assign (resid 2 and name HA )(resid 6 and name HD* ) 3.50 0.60 1.60 assign (resid 16 and name HN )(resid 12 and name HG1* ) 4.00 0.75 5.10 remarks was shor4fsl.tbl now otherlb assign (resid 8 and name HB* )(resid 10 and name HN ) 3.60 0.50 3.10 assign (resid 16 and name HN )(resid 12 and name HG1* ) 3.50 0.35 6.00 assign (resid 16 and name HA )(resid 12 and name HG1* ) 3.50 0.50 6.00 assign (resid 16 and name HB* )(resid 12 and name HG1* ) 3.50 0.60 6.00 assign (resid 10 and name HN )(resid 12 and name HN ) 4.00 0.75 6.00 assign (resid 13 and name HN )(resid 17 and name HB* ) 4.00 0.55 9.00 assign (resid 16 and name HD2 )(resid 17 and name HN ) 4.00 0.90 9.00 assign (resid 2 and name HA )(resid 6 and name HD* ) 4.00 1.10 3.10 assign (resid 2 and name HA )(resid 16 and name HB* ) 4.00 0.75 9.00 assign (resid 2 and name HA )(resid 16 and name HD2 ) 4.00 0.90 9.00 assign (resid 2 and name HA )(resid 15 and name HB* ) 4.00 0.90 9.00 assign (resid 2 and name HB* )(resid 4 and name HN ) 4.00 1.15 6.00 assign (resid 3 and name HN )(resid 16 and name HD2 ) 4.00 0.80 9.00 assign (resid 3 and name HN )(resid 12 and name HG2* ) 4.00 0.70 9.00 assign (resid 5 and name HA )(resid 6 and name HD* ) 4.00 0.95 6.00 assign (resid 5 and name HN )(resid 11 and name HB* ) 4.00 0.85 9.00 assign (resid 13 and name HA )(resid 18 and name HN ) 4.00 1.50 6.00 assign (resid 13 and name HA )(resid 16 and name HD2 ) 4.00 0.85 6.00 assign (resid 17 and name HA )(resid 19 and name HN ) 4.00 0.60 3.10 assign (resid 16 and name HA )(resid 19 and name HN ) 4.00 0.60 5.10 remarks cterm1.tbl assign (resid 18 and name HA )(resid 19 and name HN ) 2.68 0.34 0.32 assign (resid 19 and name HA )(resid 20 and name HN ) 2.25 0.20 0.28 assign (resid 20 and name HA )(resid 21 and name HN ) 2.35 0.15 0.20 assign (resid 13 and name HA )(resid 18 and name HB* ) 4.00 0.70 6.00 assign (resid 13 and name HA )(resid 19 and name HD* ) 4.00 0.90 9.00 assign (resid 16 and name HD2 )(resid 18 and name HB* ) 4.00 1.10 9.00 assign (resid 18 and name HN )(resid 19 and name HN ) 3.35 0.30 0.45 assign (resid 19 and name HN )(resid 20 and name HN ) 3.15 0.25 0.47 assign (resid 17 and name HA )(resid 18 and name HN ) 2.58 0.30 0.28 assign (resid 19 and name HN )(resid 18 and name HB* ) 3.35 0.28 1.30 assign (resid 20 and name HN )(resid 21 and name HN ) 3.70 0.55 0.60 assign (resid 20 and name HB )(resid 21 and name HN ) 3.30 0.35 0.35 assign (resid 18 and name HN )(resid 17 and name HB* ) 3.00 0.50 0.50 assign (resid 16 and name HN )(resid 17 and name HB* ) 3.70 0.35 0.90 assign (resid 17 and name HN )(resid 18 and name HN ) 3.35 0.30 0.25 remarks short2 .tbl remarks aryl side chain, etc. that could have motion problems assign (resid 13 and name HD* )(resid 13 and name HA ) 2.70 0.25 0.55 assign (resid 13 and name HD* )(resid 13 and name HN ) 3.10 0.45 0.45 assign (resid 13 and name HD* )(resid 13 and name HB* ) 2.55 0.35 0.45 assign (resid 14 and name HD* )(resid 14 and name HN ) 3.00 0.35 0.45 assign (resid 14 and name HD* )(resid 14 and name HA ) 2.70 0.25 0.55 assign (resid 14 and name HD* )(resid 14 and name HB* ) 2.40 0.25 0.68 assign (resid 14 and name HD* )(resid 11 and name HA ) 3.90 0.35 0.90
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