Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "87d9e02498e41d67458e31062a539103",
"space_group_name": "P 1",
"unit_cell": {
"a": 42.156,
"b": 53.122,
"c": 54.809,
"alpha": 103.983,
"beta": 101.997,
"gamma": 100.048
},
"wavelengths": [0.95373],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [52.5,2.55],
"number_observations_unique": 14036,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.139
},
{
"type": "R(pim)",
"value": 0.086
},
{
"type": "I/SigI",
"value": 4.94
},
{
"type": "Completeness",
"value": 98.18
},
{
"type": "Redundancy",
"value": 4.2
},
{
"type": "CC(1/2)",
"value": 0.912
}
]
},
"refln_shells": [
{
"resolution_limits": [2.64,2.55],
"number_observations_unique": 1408,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.781
},
{
"type": "R(pim)",
"value": 0.4345
},
{
"type": "I/SigI",
"value": 1.28
},
{
"type": "Completeness",
"value": 97.6
},
{
"type": "CC(1/2)",
"value": 0.564
}
]
}
]
}