Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "765931074f496c59b4ab5312b4255a2f",
"space_group_name": "I 2 2 2",
"unit_cell": {
"a": 66.11,
"b": 89.56,
"c": 100.29,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [36.490,1.610],
"number_observations": 489900,
"number_observations_unique": 38641,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.109
},
{
"type": "R(meas)",
"value": 0.113
},
{
"type": "R(pim)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 18.200
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 12.700
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.650,1.610],
"number_observations": 27691,
"number_observations_unique": 2811,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.533
},
{
"type": "R(meas)",
"value": 1.617
},
{
"type": "R(pim)",
"value": 0.504
},
{
"type": "I/SigI",
"value": 1.600
},
{
"type": "Completeness",
"value": 98.700
},
{
"type": "Redundancy",
"value": 9.900
},
{
"type": "CC(1/2)",
"value": 0.571
}
]
},
{
"resolution_limits": [36.490,7.200],
"number_observations": 5587,
"number_observations_unique": 495,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.035
},
{
"type": "R(meas)",
"value": 0.036
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 52.900
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 11.300
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}