Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "91459b084b3f7f53fdd23692b479b8a0",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 113.644,
"b": 53.331,
"c": 44.650,
"alpha": 90.00,
"beta": 101.52,
"gamma": 90.00
},
"wavelengths": [0.91258],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [55.67,1.96],
"number_observations": 59819,
"number_observations_unique": 18601,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.140
},
{
"type": "R(meas)",
"value": 0.172
},
{
"type": "R(pim)",
"value": 0.097
},
{
"type": "I/SigI",
"value": 6.4
},
{
"type": "Completeness",
"value": 98.1
},
{
"type": "Redundancy",
"value": 3.2
},
{
"type": "CC(1/2)",
"value": 0.450
}
]
},
"refln_shells": [
{
"resolution_limits": [2.01,1.96],
"number_observations": 4127,
"number_observations_unique": 1255,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.486
},
{
"type": "R(meas)",
"value": 1.773
},
{
"type": "R(pim)",
"value": 0.957
},
{
"type": "I/SigI",
"value": 0.5
},
{
"type": "Redundancy",
"value": 3.3
},
{
"type": "CC(1/2)",
"value": 0.362
}
]
}
]
}