Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "2dc76cd5c0e256ea57e1ebc6f766a36d",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 126.823,
"b": 42.176,
"c": 71.522,
"alpha": 90.000,
"beta": 123.509,
"gamma": 90.000
},
"wavelengths": [0.92000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [21.40,1.9],
"number_observations_unique": 25168,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.08096
},
{
"type": "R(meas)",
"value": 0.08813
},
{
"type": "R(pim)",
"value": 0.03443
},
{
"type": "I/SigI",
"value": 14.57
},
{
"type": "Completeness",
"value": 99.84
},
{
"type": "Redundancy",
"value": 6.7
},
{
"type": "CC(1/2)",
"value": 0.985
}
]
},
"refln_shells": [
{
"resolution_limits": [1.98,1.9],
"number_observations_unique": 2501,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.4644
},
{
"type": "R(meas)",
"value": 0.5099
},
{
"type": "R(pim)",
"value": 0.2069
},
{
"type": "I/SigI",
"value": 1.66
},
{
"type": "Completeness",
"value": 99.92
},
{
"type": "Redundancy",
"value": 6.0
},
{
"type": "CC(1/2)",
"value": 0.903
}
]
}
]
}