Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e804b009a4ad8213884fe30974f66355",
"space_group_name": "P 1",
"unit_cell": {
"a": 48.967,
"b": 55.291,
"c": 76.092,
"alpha": 104.07,
"beta": 100.37,
"gamma": 108.67
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [70.840,1.720],
"number_observations": 247327,
"number_observations_unique": 68874,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.083
},
{
"type": "R(meas)",
"value": 0.098
},
{
"type": "R(pim)",
"value": 0.052
},
{
"type": "I/SigI",
"value": 13.200
},
{
"type": "Completeness",
"value": 92.300
},
{
"type": "Redundancy",
"value": 3.600
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
},
"refln_shells": [
{
"resolution_limits": [1.750,1.720],
"number_observations": 9214,
"number_observations_unique": 2745,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.362
},
{
"type": "R(meas)",
"value": 0.427
},
{
"type": "R(pim)",
"value": 0.223
},
{
"type": "I/SigI",
"value": 4.100
},
{
"type": "Completeness",
"value": 69.200
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 0.884
}
]
},
{
"resolution_limits": [70.840,9.110],
"number_observations": 1532,
"number_observations_unique": 447,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.050
},
{
"type": "R(meas)",
"value": 0.060
},
{
"type": "R(pim)",
"value": 0.033
},
{
"type": "I/SigI",
"value": 25.500
},
{
"type": "Completeness",
"value": 88.000
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 0.987
}
]
}
]
}