Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "858f55af06c81f4b8c0cfc95a27e91e6",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 167.737,
"b": 78.017,
"c": 81.807,
"alpha": 90.00,
"beta": 103.92,
"gamma": 90.00
},
"wavelengths": [0.87310],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [70.36,2.40],
"number_observations": 280654,
"number_observations_unique": 40131,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.294
},
{
"type": "R(meas)",
"value": 0.318
},
{
"type": "R(pim)",
"value": 0.119
},
{
"type": "I/SigI",
"value": 5.1
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 7.0
},
{
"type": "CC(1/2)",
"value": 0.985
}
]
},
"refln_shells": [
{
"resolution_limits": [2.49,2.40],
"number_observations": 29943,
"number_observations_unique": 4203,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.702
},
{
"type": "R(meas)",
"value": 1.835
},
{
"type": "R(pim)",
"value": 0.682
},
{
"type": "I/SigI",
"value": 1.1
},
{
"type": "Redundancy",
"value": 7.1
},
{
"type": "CC(1/2)",
"value": 0.580
}
]
}
]
}