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
17141 2bbm cing 1-original 7 XPLOR/CNS distance hydrogen bond simple 

!!restraints for 4 Ca2+ ions
! contraints for Ca2+ (resid 181 182 183 184)
! site I
assign (resid   20 and  name OD2  )(resid  181 and  name MN   ) 2.5 1.3 0.8 !#
assign (resid   22 and  name OD1  )(resid  181 and  name MN   ) 2.5 1.3 0.8 !#
assign (resid   24 and  name OD2  )(resid  181 and  name MN   ) 2.5 1.3 0.8 !#
assign (resid   26 and  name O    )(resid  181 and  name MN   ) 2.5 1.3 0.8 !#
assign (resid   31 and  name OE1  )(resid  181 and  name MN   ) 2.5 1.3 0.8 !#
assign (resid   31 and  name OE2  )(resid  181 and  name MN   ) 2.5 1.3 0.8 !#
! site II
assign (resid   56 and  name OD2  )(resid  182 and  name MN   ) 2.5 1.3 0.8 !#
assign (resid   58 and  name OD2  )(resid  182 and  name MN   ) 2.5 1.3 0.8 !#
assign (resid   60 and  name OD1  )(resid  182 and  name MN   ) 2.5 1.3 0.8 !#
assign (resid   62 and  name O    )(resid  182 and  name MN   ) 2.5 1.3 0.8 !#
assign (resid   67 and  name OE1  )(resid  182 and  name MN   ) 2.5 1.3 0.8 !#
assign (resid   67 and  name OE2  )(resid  182 and  name MN   ) 2.5 1.3 0.8 !#
! site III
assign (resid   93 and  name OD2  )(resid  183 and  name MN   ) 2.5 1.3 0.8 !#
assign (resid   95 and  name OD2  )(resid  183 and  name MN   ) 2.5 1.3 0.8 !#
assign (resid   97 and  name OD1  )(resid  183 and  name MN   ) 2.5 1.3 0.8 !#
assign (resid   99 and  name O    )(resid  183 and  name MN   ) 2.5 1.3 0.8 !#
assign (resid  104 and  name OE1  )(resid  183 and  name MN   ) 2.5 1.3 0.8 !#
assign (resid  104 and  name OE2  )(resid  183 and  name MN   ) 2.5 1.3 0.8 !#
! site IV
assign (resid  129 and  name OD2  )(resid  184 and  name MN   ) 2.5 1.3 0.8 !#
assign (resid  131 and  name OD2  )(resid  184 and  name MN   ) 2.5 1.3 0.8 !#
assign (resid  133 and  name OD2  )(resid  184 and  name MN   ) 2.5 1.3 0.8 !#
assign (resid  135 and  name O    )(resid  184 and  name MN   ) 2.5 1.3 0.8 !#
assign (resid  140 and  name OE1  )(resid  184 and  name MN   ) 2.5 1.3 0.8 !#
assign (resid  140 and  name OE2  )(resid  184 and  name MN   ) 2.5 1.3 0.8 !#

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