Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "71f69a8f4340b752c4e85ff7fa66f499",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 183.529,
"b": 58.630,
"c": 67.220,
"alpha": 90.00,
"beta": 94.92,
"gamma": 90.00
},
"wavelengths": [0.97930],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [30.000,1.540],
"number_observations": 376716,
"number_observations_unique": 99870,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.105
},
{
"type": "R(meas)",
"value": 0.123
},
{
"type": "R(pim)",
"value": 0.063
},
{
"type": "I/SigI",
"value": 7.200
},
{
"type": "Completeness",
"value": 95.000
},
{
"type": "Redundancy",
"value": 3.800
},
{
"type": "CC(1/2)",
"value": 0.987
}
]
},
"refln_shells": [
{
"resolution_limits": [1.620,1.540],
"number_observations": 53926,
"number_observations_unique": 14139,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.556
},
{
"type": "R(pim)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 2.100
},
{
"type": "Completeness",
"value": 92.400
},
{
"type": "Redundancy",
"value": 3.800
},
{
"type": "CC(1/2)",
"value": 0.813
}
]
},
{
"resolution_limits": [30.000,4.870],
"number_observations": 13782,
"number_observations_unique": 3387,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.044
},
{
"type": "R(pim)",
"value": 0.038
},
{
"type": "I/SigI",
"value": 14.500
},
{
"type": "Completeness",
"value": 98.200
},
{
"type": "Redundancy",
"value": 4.100
},
{
"type": "CC(1/2)",
"value": 0.990
}
]
}
]
}