Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8c1128d1fcb5855c2a79ddb9aff6515e",
"space_group_name": "P 1",
"unit_cell": {
"a": 49.01,
"b": 59.63,
"c": 79.83,
"alpha": 79.41,
"beta": 81.64,
"gamma": 75.79
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.030,2.030],
"number_observations": 93805,
"number_observations_unique": 53231,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.076
},
{
"type": "R(meas)",
"value": 0.108
},
{
"type": "R(pim)",
"value": 0.076
},
{
"type": "I/SigI",
"value": 7.000
},
{
"type": "Completeness",
"value": 96.200
},
{
"type": "Redundancy",
"value": 1.800
},
{
"type": "CC(1/2)",
"value": 0.990
}
]
},
"refln_shells": [
{
"resolution_limits": [2.080,2.030],
"number_observations": 6534,
"number_observations_unique": 3867,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.522
},
{
"type": "R(meas)",
"value": 0.739
},
{
"type": "R(pim)",
"value": 0.522
},
{
"type": "I/SigI",
"value": 1.300
},
{
"type": "Completeness",
"value": 94.800
},
{
"type": "Redundancy",
"value": 1.700
},
{
"type": "CC(1/2)",
"value": 0.746
}
]
},
{
"resolution_limits": [43.030,9.080],
"number_observations": 1194,
"number_observations_unique": 606,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.026
},
{
"type": "R(meas)",
"value": 0.037
},
{
"type": "R(pim)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 19.600
},
{
"type": "Completeness",
"value": 97.600
},
{
"type": "Redundancy",
"value": 2.000
},
{
"type": "CC(1/2)",
"value": 0.990
}
]
}
]
}