Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "be0d389c017fc622dd90938065a8037f",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 44.454,
"b": 78.058,
"c": 115.075,
"alpha": 90.00,
"beta": 98.93,
"gamma": 90.00
},
"wavelengths": [0.96546],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [78.06,2.40],
"number_observations": 80117,
"number_observations_unique": 29339,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.146
},
{
"type": "R(meas)",
"value": 0.180
},
{
"type": "R(pim)",
"value": 0.104
},
{
"type": "I/SigI",
"value": 7.4
},
{
"type": "Completeness",
"value": 96.1
},
{
"type": "Redundancy",
"value": 2.7
},
{
"type": "CC(1/2)",
"value": 0.973
}
]
},
"refln_shells": [
{
"resolution_limits": [2.49,2.40],
"number_observations_unique": 3164,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.838
},
{
"type": "R(meas)",
"value": 1.0
},
{
"type": "R(pim)",
"value": 0.609
},
{
"type": "Redundancy",
"value": 2.6
},
{
"type": "CC(1/2)",
"value": 0.361
}
]
}
]
}