Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "483c11701da1fe661a567d259445f997",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 112.561,
"b": 52.771,
"c": 44.375,
"alpha": 90.00,
"beta": 102.97,
"gamma": 90.00
},
"wavelengths": [0.91260],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [54.940,1.690],
"number_observations": 98317,
"number_observations_unique": 28373,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.097
},
{
"type": "R(meas)",
"value": 0.115
},
{
"type": "R(pim)",
"value": 0.060
},
{
"type": "I/SigI",
"value": 7.400
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 3.500
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.720,1.690],
"number_observations": 4498,
"number_observations_unique": 1504,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.433
},
{
"type": "R(meas)",
"value": 1.736
},
{
"type": "R(pim)",
"value": 0.966
},
{
"type": "I/SigI",
"value": 0.700
},
{
"type": "Completeness",
"value": 97.100
},
{
"type": "Redundancy",
"value": 3.000
},
{
"type": "CC(1/2)",
"value": 0.296
}
]
},
{
"resolution_limits": [54.940,8.790],
"number_observations": 833,
"number_observations_unique": 220,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.031
},
{
"type": "R(meas)",
"value": 0.036
},
{
"type": "R(pim)",
"value": 0.018
},
{
"type": "I/SigI",
"value": 33.200
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 3.800
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}