Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "77b422e2f8c8876bfdc4d8f4c846dcc6",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 72.545,
"b": 61.312,
"c": 65.001,
"alpha": 90.00,
"beta": 92.38,
"gamma": 90.00
},
"wavelengths": [0.92202],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [32.48,1.40],
"number_observations": 349260,
"number_observations_unique": 56059,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.092
},
{
"type": "R(meas)",
"value": 0.100
},
{
"type": "R(pim)",
"value": 0.039
},
{
"type": "I/SigI",
"value": 8.7
},
{
"type": "Completeness",
"value": 99.3
},
{
"type": "Redundancy",
"value": 6.2
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.42,1.40],
"number_observations": 10123,
"number_observations_unique": 2357,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.588
},
{
"type": "R(meas)",
"value": 1.811
},
{
"type": "R(pim)",
"value": 0.856
},
{
"type": "I/SigI",
"value": 0.3
},
{
"type": "Redundancy",
"value": 4.3
},
{
"type": "CC(1/2)",
"value": 0.407
}
]
}
]
}