Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4c1e7aa4e60d4275f2049f2f2cf4f99e",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 41.230,
"b": 74.136,
"c": 96.774,
"alpha": 90.00,
"beta": 90.43,
"gamma": 90.00
},
"wavelengths": [0.88560],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [20,1.50],
"number_observations_unique": 92976,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.057
},
{
"type": "R(meas)",
"value": 0.064
},
{
"type": "R(pim)",
"value": 0.029
},
{
"type": "I/SigI",
"value": 12.55
},
{
"type": "Completeness",
"value": 99.72
},
{
"type": "Redundancy",
"value": 4.6
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.61,1.55],
"number_observations_unique": 8403,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.054
},
{
"type": "R(meas)",
"value": 1.188
},
{
"type": "R(pim)",
"value": 0.543
},
{
"type": "I/SigI",
"value": 1.01
},
{
"type": "Completeness",
"value": 98.91
},
{
"type": "Redundancy",
"value": 4.6
},
{
"type": "CC(1/2)",
"value": 0.585
}
]
}
]
}