NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype |
11061 | 1qvl | 6041 | cing | 1-original | 3 | AMBER | stereochemistry | chirality |
############### chirality and trans omega restraints ############# # # chirality for residue 1 atoms: CA CG HB2 HB3 &rst iat=3,8,6,7, r1=10., r2=60., r3=80., r4=130., rk2 = 150., rk3=150., &end # # chirality for residue 1 atoms: CB CD HG2 HG3 &rst iat=5,11,9,10, &end # # chirality for residue 1 atoms: CG NE HD2 HD3 &rst iat=8,14,12,13, &end # # chirality for residue 1 atoms: N C HA CB &rst iat=1,23,4,5, &end # # chirality for residue 2 atoms: CA CG HB2 HB3 &rst iat=27,32,30,31, &end # # chirality for residue 2 atoms: CB CD HG2 HG3 &rst iat=29,35,33,34, &end # # chirality for residue 2 atoms: CG NE HD2 HD3 &rst iat=32,38,36,37, &end # # chirality for residue 2 atoms: N C HA CB &rst iat=25,47,28,29, &end # # chirality for residue 3 atoms: CA CG HB2 HB3 &rst iat=51,56,54,55, &end # # chirality for residue 3 atoms: N C HA CB &rst iat=49,71,52,53, &end # # chirality for residue 4 atoms: CA CG HB2 HB3 &rst iat=75,80,78,79, &end # # chirality for residue 4 atoms: N C HA CB &rst iat=73,95,76,77, &end # # chirality for residue 5 atoms: CA CG HB2 HB3 &rst iat=99,104,102,103, &end # # chirality for residue 5 atoms: CB CD HG2 HG3 &rst iat=101,107,105,106, &end # # chirality for residue 5 atoms: CG NE HD2 HD3 &rst iat=104,110,108,109, &end # # chirality for residue 5 atoms: N C HA CB &rst iat=97,119,100,101, &end # # chirality for residue 6 atoms: CA CG HB2 HB3 &rst iat=123,128,126,127, &end # # chirality for residue 6 atoms: N C HA CB &rst iat=121,139,124,125, &end #
Contact the webmaster for help, if required. Saturday, May 11, 2024 12:30:20 PM GMT (wattos1)