Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8c5cbccab997a8e0bd802b314803e270",
"space_group_name": "P 65 2 2",
"unit_cell": {
"a": 63.542,
"b": 63.542,
"c": 201.586,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97850],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.300,2.200],
"number_observations_unique": 23116,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.131
},
{
"type": "R(meas)",
"value": 0.133
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 17.600
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 36.000
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.270,2.200],
"number_observations": 40783,
"number_observations_unique": 1102,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.137
},
{
"type": "R(meas)",
"value": 2.166
},
{
"type": "R(pim)",
"value": 0.350
},
{
"type": "I/SigI",
"value": 2.300
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 37.000
},
{
"type": "CC(1/2)",
"value": 0.732
}
]
},
{
"resolution_limits": [48.300,9.070],
"number_observations": 5973,
"number_observations_unique": 253,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.095
},
{
"type": "R(meas)",
"value": 0.097
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 33.400
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 23.600
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
}
]
}