Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "632697581cc2426f2e23d07b6ac28dd7",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 71.997,
"b": 170.813,
"c": 72.148,
"alpha": 90.000,
"beta": 117.828,
"gamma": 90.000
},
"wavelengths": [0.97910],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [42.70,3.04],
"number_observations_unique": 29424,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.151
},
{
"type": "I/SigI",
"value": 4.8
},
{
"type": "Completeness",
"value": 99.2
},
{
"type": "Redundancy",
"value": 3.7
},
{
"type": "CC(1/2)",
"value": 0.988
}
]
},
"refln_shells": [
{
"resolution_limits": [3.11,3.04],
"number_observations_unique": 4770,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.631
},
{
"type": "I/SigI",
"value": 0.8
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 3.8
},
{
"type": "CC(1/2)",
"value": 0.293
}
]
}
]
}