Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "e30106efb091ded26fb00c5bbbd40946",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 43.447,
"b": 101.734,
"c": 144.238,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.11585],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.080,2.040],
"number_observations": 266384,
"number_observations_unique": 41564,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.110
},
{
"type": "R(meas)",
"value": 0.120
},
{
"type": "R(pim)",
"value": 0.047
},
{
"type": "I/SigI",
"value": 10.000
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.400
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.100,2.040],
"number_observations": 18890,
"number_observations_unique": 3146,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.422
},
{
"type": "R(meas)",
"value": 2.651
},
{
"type": "R(pim)",
"value": 1.062
},
{
"type": "I/SigI",
"value": 0.700
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 6.000
},
{
"type": "CC(1/2)",
"value": 0.325
}
]
},
{
"resolution_limits": [48.080,8.900],
"number_observations": 3345,
"number_observations_unique": 598,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.036
},
{
"type": "R(meas)",
"value": 0.039
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 38.500
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 5.600
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}