Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "46bbd65fd6236efea9761c188e8e65f5",
"space_group_name": "P 21 2 21",
"unit_cell": {
"a": 43.068,
"b": 64.304,
"c": 85.293,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97993],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.070,1.350],
"number_observations_unique": 51539,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.041
},
{
"type": "R(meas)",
"value": 0.044
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 18.900
},
{
"type": "Completeness",
"value": 97.900
},
{
"type": "Redundancy",
"value": 6.700
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.370,1.350],
"number_observations_unique": 2525,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.174
},
{
"type": "R(meas)",
"value": 1.268
},
{
"type": "R(pim)",
"value": 0.476
},
{
"type": "Completeness",
"value": 95.300
},
{
"type": "Redundancy",
"value": 6.900
},
{
"type": "CC(1/2)",
"value": 0.672
}
]
},
{
"resolution_limits": [43.070,7.270],
"number_observations_unique": 369,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.031
},
{
"type": "R(meas)",
"value": 0.034
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "Completeness",
"value": 91.900
},
{
"type": "Redundancy",
"value": 5.300
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}