NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
9030 | 1na2 | 5632 | cing | 1-original | 2 | XPLOR/CNS | planarity |
!{* keep Gua amino groups flat *} for $namin in (1 2 3 6 15 18 26) loop amino restraints dihedral scale= 1.0 assign (resid $namin and name H21 ) (resid $namin and name N2 ) (resid $namin and name C2 ) (resid $namin and name N1 ) 3.0 0.0 3.0 2 assign (resid $namin and name H22 ) (resid $namin and name N2 ) (resid $namin and name C2 ) (resid $namin and name N3 ) 3.0 0.0 3.0 2 end end loop amino !{* keep cytosine amino flat *} for $namin2 in (4 12 14 16 20 24 27 28 29 30) loop amino2 restraints dihedral scale= 1.0 assign (resid $namin2 and name H41) (resid $namin2 and name N4 ) (resid $namin2 and name C4 ) (resid $namin2 and name N3 ) 3.0 0.0 3.0 2 assign (resid $namin2 and name H42) (resid $namin2 and name N4 ) (resid $namin2 and name C4 ) (resid $namin2 and name C5 ) 3.0 0.0 3.0 2 end end loop amino2 !{* keep adenine amino flat *} for $namin3 in (19 25) loop amino3 restraints dihedral scale= 1.0 assign (resid $namin3 and name H61) (resid $namin3 and name N6 ) (resid $namin3 and name C6 ) (resid $namin3 and name N1 ) 3.0 0.0 3.0 2 assign (resid $namin3 and name H62) (resid $namin3 and name N6 ) (resid $namin3 and name C6 ) (resid $namin3 and name C5 ) 3.0 0.0 3.0 2 end end loop amino3
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