Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "deef95d0916ec1aad4eb4c364e276183",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 138.134,
"b": 65.543,
"c": 84.434,
"alpha": 90.00,
"beta": 93.35,
"gamma": 90.00
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [84.290,1.700],
"number_observations": 252391,
"number_observations_unique": 82316,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.082
},
{
"type": "R(meas)",
"value": 0.099
},
{
"type": "R(pim)",
"value": 0.055
},
{
"type": "I/SigI",
"value": 7.900
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 3.100
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [1.740,1.700],
"number_observations": 12983,
"number_observations_unique": 5707,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.874
},
{
"type": "R(meas)",
"value": 1.113
},
{
"type": "R(pim)",
"value": 0.680
},
{
"type": "I/SigI",
"value": 1.000
},
{
"type": "Completeness",
"value": 94.100
},
{
"type": "Redundancy",
"value": 2.300
},
{
"type": "CC(1/2)",
"value": 0.419
}
]
},
{
"resolution_limits": [84.290,7.600],
"number_observations": 3134,
"number_observations_unique": 989,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.033
},
{
"type": "R(meas)",
"value": 0.040
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 25.400
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 3.200
},
{
"type": "CC(1/2)",
"value": 0.990
}
]
}
]
}