Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "60dc0ecb5a2b682d329371c1d8a04b65",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 51.89,
"b": 57.13,
"c": 115.18,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [57.590,1.700],
"number_observations": 239627,
"number_observations_unique": 38515,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.127
},
{
"type": "R(meas)",
"value": 0.139
},
{
"type": "R(pim)",
"value": 0.056
},
{
"type": "I/SigI",
"value": 11.700
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.200
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.740,1.700],
"number_observations": 17954,
"number_observations_unique": 2825,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.657
},
{
"type": "R(meas)",
"value": 1.805
},
{
"type": "R(pim)",
"value": 0.709
},
{
"type": "I/SigI",
"value": 1.100
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.400
},
{
"type": "CC(1/2)",
"value": 0.495
}
]
},
{
"resolution_limits": [57.590,7.600],
"number_observations": 3052,
"number_observations_unique": 519,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.035
},
{
"type": "R(meas)",
"value": 0.038
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "I/SigI",
"value": 48.400
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 5.900
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}