Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "95e0f2d3dab1eca72c2df1fb37ec7b47",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 152.282,
"b": 127.186,
"c": 72.976,
"alpha": 90.000,
"beta": 117.597,
"gamma": 90.000
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [92.56,3.05],
"number_observations_unique": 23188,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.130
},
{
"type": "R(meas)",
"value": 0.140
},
{
"type": "R(pim)",
"value": 0.053
},
{
"type": "I/SigI",
"value": 11.3
},
{
"type": "Completeness",
"value": 98.6
},
{
"type": "Redundancy",
"value": 7.0
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [3.26,3.05],
"number_observations_unique": 4136,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.060
},
{
"type": "R(meas)",
"value": 1.151
},
{
"type": "R(pim)",
"value": 0.443
},
{
"type": "I/SigI",
"value": 2.0
},
{
"type": "Completeness",
"value": 97.6
},
{
"type": "Redundancy",
"value": 6.6
},
{
"type": "CC(1/2)",
"value": 0.891
}
]
}
]
}