Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1eea8aae7aadd02855a04efb372238da",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 125.439,
"b": 108.231,
"c": 75.674,
"alpha": 90.00,
"beta": 108.89,
"gamma": 90.00
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [60.277,1.629],
"number_observations": 261097,
"number_observations_unique": 75578,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.112
},
{
"type": "R(pim)",
"value": 0.060
},
{
"type": "I/SigI",
"value": 8.200
},
{
"type": "Completeness",
"value": 92.600
},
{
"type": "Redundancy",
"value": 3.500
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.832,1.629],
"number_observations": 12896,
"number_observations_unique": 3780,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.976
},
{
"type": "R(pim)",
"value": 0.518
},
{
"type": "I/SigI",
"value": 1.600
},
{
"type": "Completeness",
"value": 66.400
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 0.533
}
]
},
{
"resolution_limits": [60.277,5.151],
"number_observations": 12841,
"number_observations_unique": 3779,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.043
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 21.300
},
{
"type": "Completeness",
"value": 98.100
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}