Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "32a5062c44591fb5e8fa1577a630586b",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 77.08,
"b": 83.93,
"c": 189.08,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97930],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [25.880,2.000],
"number_observations": 563578,
"number_observations_unique": 38991,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.116
},
{
"type": "R(pim)",
"value": 0.032
},
{
"type": "I/SigI",
"value": 15.800
},
{
"type": "Completeness",
"value": 93.100
},
{
"type": "Redundancy",
"value": 14.500
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.050,2.000],
"number_observations": 45186,
"number_observations_unique": 3078,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.318
},
{
"type": "R(pim)",
"value": 0.085
},
{
"type": "I/SigI",
"value": 7.400
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 14.700
},
{
"type": "CC(1/2)",
"value": 0.984
}
]
},
{
"resolution_limits": [25.880,8.940],
"number_observations": 6607,
"number_observations_unique": 516,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.040
},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "I/SigI",
"value": 31.100
},
{
"type": "Completeness",
"value": 95.900
},
{
"type": "Redundancy",
"value": 12.800
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}