Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9dc71334d443e2ff78315168713920f1",
"space_group_name": "P 1",
"unit_cell": {
"a": 31.86,
"b": 45.27,
"c": 50.48,
"alpha": 110.19,
"beta": 106.04,
"gamma": 90.07
},
"wavelengths": [0.97910],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [45.270,2.140],
"number_observations": 40277,
"number_observations_unique": 12451,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.098
},
{
"type": "R(meas)",
"value": 0.118
},
{
"type": "R(pim)",
"value": 0.064
},
{
"type": "I/SigI",
"value": 8.100
},
{
"type": "Completeness",
"value": 89.600
},
{
"type": "Redundancy",
"value": 3.200
},
{
"type": "CC(1/2)",
"value": 0.981
}
]
},
"refln_shells": [
{
"resolution_limits": [2.210,2.140],
"number_observations": 3411,
"number_observations_unique": 1039,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.234
},
{
"type": "R(meas)",
"value": 0.279
},
{
"type": "R(pim)",
"value": 0.150
},
{
"type": "I/SigI",
"value": 4.000
},
{
"type": "Completeness",
"value": 91.500
},
{
"type": "Redundancy",
"value": 3.300
},
{
"type": "CC(1/2)",
"value": 0.934
}
]
},
{
"resolution_limits": [45.270,9.090],
"number_observations": 498,
"number_observations_unique": 164,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.102
},
{
"type": "R(meas)",
"value": 0.125
},
{
"type": "R(pim)",
"value": 0.071
},
{
"type": "I/SigI",
"value": 12.100
},
{
"type": "Completeness",
"value": 89.100
},
{
"type": "Redundancy",
"value": 3.000
},
{
"type": "CC(1/2)",
"value": 0.954
}
]
}
]
}