Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "28d6c2f73523ce24ccc5bb49a7984e63",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 52.02,
"b": 89.35,
"c": 144.70,
"alpha": 90.00,
"beta": 98.61,
"gamma": 90.00
},
"wavelengths": [1.54180],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [51.43,2.00],
"number_observations_unique": 87255,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.096
},
{
"type": "R(meas)",
"value": 0.113
},
{
"type": "R(pim)",
"value": 0.059
},
{
"type": "I/SigI",
"value": 9.4
},
{
"type": "Completeness",
"value": 98.64
},
{
"type": "Redundancy",
"value": 3.6
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.03,2.00],
"number_observations_unique": 4039,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.859
},
{
"type": "R(meas)",
"value": 1.019
},
{
"type": "R(pim)",
"value": 0.541
},
{
"type": "I/SigI",
"value": 1.3
},
{
"type": "Completeness",
"value": 93.15
},
{
"type": "Redundancy",
"value": 3.36
},
{
"type": "CC(1/2)",
"value": 0.485
}
]
}
]
}