XmlmmCIF equivalent: refine_ls_restr Data items in the REFINE_LS_RESTR category record details about the restraints applied to various classes of parameters during least-squares refinement. XmlmmCIF equivalent: refine_ls_restr/criterion A criterion used to define a parameter value that deviates significantly from its ideal value in the model obtained by restrained least-squares refinement. XmlmmCIF equivalent: refine_ls_restr/dev_ideal For the given parameter type, the root-mean-square deviation between the ideal values used as restraints in the least-squares refinement and the values obtained by refinement. For instance, bond distances may deviate by 0.018 \%A (r.m.s.) from ideal values in current model. XmlmmCIF equivalent: refine_ls_restr/dev_ideal_target For the given parameter type, the target root-mean-square deviation between the ideal values used as restraints in the least-squares refinement and the values obtained by refinement. XmlmmCIF equivalent: refine_ls_restr/number The number of parameters of this type subjected to restraint in least-squares refinement. XmlmmCIF equivalent: refine_ls_restr/rejects The number of parameters of this type that deviate from ideal values by more than the amount defined in _refine_ls_restr.criterion in the model obtained by restrained least-squares refinement. XmlmmCIF equivalent: refine_ls_restr/weight The weighting value applied to this type of restraint in least-squares refinement. XmlmmCIF equivalent: refine_ls_restr/type The type of the parameter being restrained. Explicit sets of data values are provided for the programs PROTIN/PROLSQ (beginning with p_) and RESTRAIN (beginning with RESTRAIN_). As computer programs will evolve, these data values are given as examples, and not as an enumeration list. Computer programs converting a data block to a refinement table will expect the exact form of the data values given here to be used.