Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f8d17d2af40fac8717537153c61e671f",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 100.43,
"b": 32.75,
"c": 72.69,
"alpha": 90.00,
"beta": 90.38,
"gamma": 90.00
},
"wavelengths": [0.96000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [72.69,1.40],
"number_observations_unique": 43787,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.066
},
{
"type": "R(meas)",
"value": 0.080
},
{
"type": "R(pim)",
"value": 0.055
},
{
"type": "I/SigI",
"value": 8.5
},
{
"type": "Completeness",
"value": 93.4
},
{
"type": "Redundancy",
"value": 2.6
},
{
"type": "CC(1/2)",
"value": 0.990
}
]
},
"refln_shells": [
{
"resolution_limits": [1.42,1.40],
"number_observations_unique": 2120,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.259
},
{
"type": "R(meas)",
"value": 0.327
},
{
"type": "R(pim)",
"value": 0.196
},
{
"type": "I/SigI",
"value": 2.4
},
{
"type": "Completeness",
"value": 91.3
},
{
"type": "Redundancy",
"value": 2.2
},
{
"type": "CC(1/2)",
"value": 0.861
}
]
}
]
}