Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "485f55ca5b573c9e7af3146e176e3824",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 68.145,
"b": 67.846,
"c": 138.596,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91788],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [69.340,2.010],
"number_observations": 295425,
"number_observations_unique": 43495,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.251
},
{
"type": "R(meas)",
"value": 0.272
},
{
"type": "R(pim)",
"value": 0.104
},
{
"type": "I/SigI",
"value": 6.100
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.800
},
{
"type": "CC(1/2)",
"value": 0.969
}
]
},
"refln_shells": [
{
"resolution_limits": [2.060,2.010],
"number_observations": 21935,
"number_observations_unique": 3147,
"quality_factors": [
{
"type": "R(merge)",
"value": 4.108
},
{
"type": "R(meas)",
"value": 4.438
},
{
"type": "R(pim)",
"value": 1.667
},
{
"type": "I/SigI",
"value": 0.300
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 7.000
},
{
"type": "CC(1/2)",
"value": 0.430
}
]
},
{
"resolution_limits": [69.340,8.990],
"number_observations": 3227,
"number_observations_unique": 583,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.045
},
{
"type": "R(meas)",
"value": 0.052
},
{
"type": "R(pim)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 45.100
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 5.500
},
{
"type": "CC(1/2)",
"value": 0.842
}
]
}
]
}