Item _phasing_MIR_der_refln.HL_B_iso

Description

              The isomorphous Hendrickson-Lattman coefficient B~iso~ for this
               reflection for this derivative.

                         -2.0 * (Fp~obs~^2^ + Fh~calc~^2^ - Fph~obs~^2^)
                              *  Fp~obs~ * sin(alphah~calc~)
               B~iso~ =  -----------------------------------------------
                                              E^2^

               E            = (Fph~obs~ - Fp~obs~ - Fh~calc~)^2^
                              for centric reflections
                            = [(Fph~obs~ - Fp~obs~) * 2^1/2^ - Fh~calc~]^2^
                              for acentric reflections

               Fp~obs~      = the observed structure factor amplitude of the
                              native
               Fph~obs~     = the observed structure factor amplitude of the
                              derivative
               Fh~calc~     = the calculated structure factor amplitude
                              from the heavy atom model
               alphah~calc~ = the phase calculated from the heavy atom model

Category

Mandatory Code

Data Type Code