Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e0190e1dc5f53426ce7de8d99cafca1a",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 67.31,
"b": 86.68,
"c": 152.85,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92820],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [57.330,2.090],
"number_observations": 292129,
"number_observations_unique": 53618,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.134
},
{
"type": "R(meas)",
"value": 0.148
},
{
"type": "R(pim)",
"value": 0.063
},
{
"type": "I/SigI",
"value": 8.900
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 5.400
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.140,2.090],
"number_observations_unique": 3915,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.266
},
{
"type": "R(meas)",
"value": 1.393
},
{
"type": "R(pim)",
"value": 0.574
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 5.700
},
{
"type": "CC(1/2)",
"value": 0.587
}
]
},
{
"resolution_limits": [57.330,9.350],
"number_observations_unique": 685,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.030
},
{
"type": "R(meas)",
"value": 0.034
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "Completeness",
"value": 98.300
},
{
"type": "Redundancy",
"value": 4.700
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}