Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4989ac2345e8bf1230373d969a9f7ad1",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 113.322,
"b": 53.191,
"c": 44.667,
"alpha": 90.00,
"beta": 102.28,
"gamma": 90.00
},
"wavelengths": [0.91264],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.94,1.97],
"number_observations": 60559,
"number_observations_unique": 18500,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.138
},
{
"type": "R(meas)",
"value": 0.166
},
{
"type": "R(pim)",
"value": 0.090
},
{
"type": "I/SigI",
"value": 4.9
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 3.3
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
},
"refln_shells": [
{
"resolution_limits": [2.02,1.97],
"number_observations": 3794,
"number_observations_unique": 1266,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.319
},
{
"type": "R(meas)",
"value": 1.604
},
{
"type": "R(pim)",
"value": 0.902
},
{
"type": "I/SigI",
"value": 0.4
},
{
"type": "Redundancy",
"value": 3.0
},
{
"type": "CC(1/2)",
"value": 0.449
}
]
}
]
}