Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4d1f529ef7821fb10497c696e8032d11",
"space_group_name": "P 1",
"unit_cell": {
"a": 44.998,
"b": 52.485,
"c": 102.152,
"alpha": 84.11,
"beta": 84.42,
"gamma": 73.25
},
"wavelengths": [1.00720],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.680,2.920],
"number_observations": 65155,
"number_observations_unique": 19067,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.155
},
{
"type": "R(meas)",
"value": 0.184
},
{
"type": "R(pim)",
"value": 0.098
},
{
"type": "I/SigI",
"value": 5.100
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 0.976
}
]
},
"refln_shells": [
{
"resolution_limits": [3.000,2.920],
"number_observations": 4756,
"number_observations_unique": 1382,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.022
},
{
"type": "R(meas)",
"value": 1.213
},
{
"type": "R(pim)",
"value": 0.643
},
{
"type": "I/SigI",
"value": 1.400
},
{
"type": "Completeness",
"value": 98.400
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 0.530
}
]
},
{
"resolution_limits": [50.680,13.060],
"number_observations": 731,
"number_observations_unique": 212,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.106
},
{
"type": "R(meas)",
"value": 0.125
},
{
"type": "R(pim)",
"value": 0.066
},
{
"type": "I/SigI",
"value": 10.100
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 0.968
}
]
}
]
}