Data Category phasing_MIR_der_refln


Category name
Required in PDB entries
Category group membership
Used in current PDB entries

Category Relationship Diagrams

View full category relationship diagram including all dictionary data categories

Category Description

               Data items in the PHASING_MIR_DER_REFLN category record details
               about the calculated structure factors obtained in an MIR
               phasing experiment.

               This list may contain information from a number of different
               derivatives; _phasing_MIR_der_refln.der_id indicates to which
               derivative a given record corresponds. (A derivative in this
               context does not necessarily equate with a data set; see the
               definition of the PHASING_MIR_DER category for a
               discussion of the meaning of derivative.)

               It is not necessary for the data items describing the measured
               value of F to appear in this list, as they will be
               given in the PHASING_SET_REFLN category. However, these
               items can also be listed here for completeness.

Category Example

    _phasing_MIR_der_refln.index_h         6
    _phasing_MIR_der_refln.index_k         1
    _phasing_MIR_der_refln.index_l        25
    _phasing_MIR_der_refln.der_id         HGPT1
    _phasing_MIR_der_refln.set_id       'NS1-96'
    _phasing_MIR_der_refln.F_calc_au     106.66
    _phasing_MIR_der_refln.F_meas_au     204.67
    _phasing_MIR_der_refln.F_meas_sigma    6.21
    _phasing_MIR_der_refln.HL_A_iso       -3.15
    _phasing_MIR_der_refln.HL_B_iso       -0.76
    _phasing_MIR_der_refln.HL_C_iso        0.65
    _phasing_MIR_der_refln.HL_D_iso        0.23
    _phasing_MIR_der_refln.phase_calc    194.48