NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | position | program | type | subtype |
650531 | 6m6j | cing | 1-original | 3 | AMBER | stereochemistry | chirality |
# chirality # chirality restraints directly generated by AMBER using makeCHIR_RST. # Mannually add chir rst for X5. # chirality for residue 1 atoms: C2' O4' N1 H1' &rst iat=25,8,11,10, r1=10., r2=60., r3=80., r4=130., rk2 = 500., rk3=500., &end # # chirality for residue 1 atoms: C3' C1' H2'1 H2'2 &rst iat=23,9,26,27, &end # # chirality for residue 1 atoms: O3' C2' C4' H3' &rst iat=28,25,6,24, &end # # chirality for residue 1 atoms: C3' C5' O4' H4' &rst iat=23,3,8,7, &end # # chirality for residue 1 atoms: C4' O5' H5'1 H5'2 &rst iat=6,2,4,5, &end # # chirality for residue 2 atoms: C2' O4' N1 H1' &rst iat=57,38,41,40, &end # # chirality for residue 2 atoms: C3' C1' H2'1 H2'2 &rst iat=55,39,58,59, &end # # chirality for residue 2 atoms: O3' C2' C4' H3' &rst iat=60,57,36,56, &end # # chirality for residue 2 atoms: C3' C5' O4' H4' &rst iat=55,33,38,37, &end # # chirality for residue 2 atoms: C4' O5' H5'1 H5'2 &rst iat=36,32,34,35, &end # # chirality for residue 3 atoms: C2' O4' N1 H1' &rst iat=89,70,73,72, &end # # chirality for residue 3 atoms: C3' C1' H2'1 H2'2 &rst iat=87,71,90,91, &end # # chirality for residue 3 atoms: O3' C2' C4' H3' &rst iat=92,89,68,88, &end # # chirality for residue 3 atoms: C3' C5' O4' H4' &rst iat=87,65,70,69, &end # # chirality for residue 3 atoms: C4' O5' H5'1 H5'2 &rst iat=68,64,66,67, &end # # chirality for residue 4 atoms: C2' O4' N9 H1' &rst iat=122,102,105,104, &end # # chirality for residue 4 atoms: C3' C1' H2'1 H2'2 &rst iat=120,103,123,124, &end # # chirality for residue 4 atoms: O3' C2' C4' H3' &rst iat=125,122,100,121, &end # # chirality for residue 4 atoms: C3' C5' O4' H4' &rst iat=120,97,102,101, &end # # chirality for residue 4 atoms: C4' O5' H5'1 H5'2 &rst iat=100,96,98,99, &end # # chirality for residue 5 atoms: C2' O4' N9 H1' &rst iat=141,135,138,137, &end # # chirality for residue 5 atoms: C3' C1' H2'1 H2'2 &rst iat=139,136,142,143, &end # # chirality for residue 5 atoms: O3' C2' C4' H3' &rst iat=144,141,133,140, &end # # chirality for residue 5 atoms: C3' C5' O4' H4' &rst iat=139,130,135,134, &end # # chirality for residue 5 atoms: C4' O5' H5'1 H5'2 &rst iat=133,129,131,132, &end # # chirality for residue 6 atoms: C2' O4' N1 H1' &rst iat=171,154,157,156, &end # # chirality for residue 6 atoms: C3' C1' H2'1 H2'2 &rst iat=169,155,172,173, &end # # chirality for residue 6 atoms: O3' C2' C4' H3' &rst iat=174,171,152,170, &end # # chirality for residue 6 atoms: C3' C5' O4' H4' &rst iat=169,149,154,153, &end # # chirality for residue 6 atoms: C4' O5' H5'1 H5'2 &rst iat=152,148,150,151, &end # # chirality for residue 7 atoms: C2' O4' N1 H1' &rst iat=203,184,187,186, &end # # chirality for residue 7 atoms: C3' C1' H2'1 H2'2 &rst iat=201,185,204,205, &end # # chirality for residue 7 atoms: O3' C2' C4' H3' &rst iat=206,203,182,202, &end # # chirality for residue 7 atoms: C3' C5' O4' H4' &rst iat=201,179,184,183, &end # # chirality for residue 7 atoms: C4' O5' H5'1 H5'2 &rst iat=182,178,180,181, &end # # chirality for residue 8 atoms: C2' O4' N1 H1' &rst iat=235,216,219,218, &end # # chirality for residue 8 atoms: C3' C1' H2'1 H2'2 &rst iat=233,217,236,237, &end # # chirality for residue 8 atoms: O3' C2' C4' H3' &rst iat=238,235,214,234, &end # # chirality for residue 8 atoms: C3' C5' O4' H4' &rst iat=233,211,216,215, &end # # chirality for residue 8 atoms: C4' O5' H5'1 H5'2 &rst iat=214,210,212,213, &end # # chirality for residue 9 atoms: C2' O4' N9 H1' &rst iat=268,248,251,250, &end # # chirality for residue 9 atoms: C3' C1' H2'1 H2'2 &rst iat=266,249,269,270, &end # # chirality for residue 9 atoms: O3' C2' C4' H3' &rst iat=271,268,246,267, &end # # chirality for residue 9 atoms: C3' C5' O4' H4' &rst iat=266,243,248,247, &end # # chirality for residue 9 atoms: C4' O5' H5'1 H5'2 &rst iat=246,242,244,245, &end
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