Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "579c94839470652028ecff90e77dd71b",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 74.39,
"b": 75.89,
"c": 95.54,
"alpha": 90.00,
"beta": 95.18,
"gamma": 90.00
},
"wavelengths": [0.97942],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.640,2.540],
"number_observations": 210998,
"number_observations_unique": 34219,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.215
},
{
"type": "R(meas)",
"value": 0.235
},
{
"type": "R(pim)",
"value": 0.093
},
{
"type": "I/SigI",
"value": 6.900
},
{
"type": "Completeness",
"value": 97.500
},
{
"type": "Redundancy",
"value": 6.200
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
},
"refln_shells": [
{
"resolution_limits": [2.650,2.540],
"number_observations": 24841,
"number_observations_unique": 4161,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.385
},
{
"type": "R(meas)",
"value": 2.612
},
{
"type": "R(pim)",
"value": 1.046
},
{
"type": "I/SigI",
"value": 1.400
},
{
"type": "Completeness",
"value": 96.900
},
{
"type": "Redundancy",
"value": 6.000
},
{
"type": "CC(1/2)",
"value": 0.413
}
]
},
{
"resolution_limits": [47.640,8.800],
"number_observations": 4990,
"number_observations_unique": 853,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.065
},
{
"type": "R(meas)",
"value": 0.072
},
{
"type": "R(pim)",
"value": 0.029
},
{
"type": "I/SigI",
"value": 19.200
},
{
"type": "Completeness",
"value": 95.800
},
{
"type": "Redundancy",
"value": 5.800
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
}
]
}