NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id cing stage position program type subtype subsubtype
648718 6iy5 cing 1-original 3 AMBER distance hydrogen bond simple


# Restraints file 3: rst_hbond.txt
# hbond
# 1	DA5	N6	7	DT	O4	2.85	3.05
 &rst
  ixpk= 0, nxpk= 0, iat=  17, 210, r1= 2.35, r2= 2.85, r3= 3.05, r4= 3.55, 
      rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
 /
#
# 1	DA5	N1	7	DT	N3	2.72	2.92
 &rst
  ixpk= 0, nxpk= 0, iat=  20, 211, r1= 2.22, r2= 2.72, r3= 2.92, r4= 3.42,  /
#
# 2	DT	O4	6	DA	N6	2.85	3.05
 &rst
  ixpk= 0, nxpk= 0, iat=  52, 175, r1= 2.35, r2= 2.85, r3= 3.05, r4= 3.55,  /
#
# 2	DT	N3	6	DA	N1	2.72	2.92
 &rst
  ixpk= 0, nxpk= 0, iat=  53, 178, r1= 2.22, r2= 2.72, r3= 2.92, r4= 3.42,  /
# Restraints file 4: auxillary_dummy.txt
# hbond
# 1	DA5	N6	7	DT	O4	2.85	3.05
 &rst
  ixpk= 0, nxpk= 0, iat=  17, 210, r1= 2.35, r2= 2.85, r3= 3.05, r4= 3.55, 
      rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
 /
#
# 1	DA5	N1	7	DT	N3	2.72	2.92
 &rst
  ixpk= 0, nxpk= 0, iat=  20, 211, r1= 2.22, r2= 2.72, r3= 2.92, r4= 3.42,  /
#
# 2	DT	O4	6	DA	N6	2.85	3.05
 &rst
  ixpk= 0, nxpk= 0, iat=  52, 175, r1= 2.35, r2= 2.85, r3= 3.05, r4= 3.55,  /
#
# 2	DT	N3	6	DA	N1	2.72	2.92
 &rst
  ixpk= 0, nxpk= 0, iat=  53, 178, r1= 2.22, r2= 2.72, r3= 2.92, r4= 3.42,  /


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