Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "cf1ddb6f144307613985aecfdbfdeeb0",
"space_group_name": "I 4",
"unit_cell": {
"a": 95.388,
"b": 95.388,
"c": 45.754,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92124],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.250,1.190],
"number_observations": 586822,
"number_observations_unique": 60873,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.056
},
{
"type": "R(meas)",
"value": 0.059
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 19.100
},
{
"type": "Completeness",
"value": 92.500
},
{
"type": "Redundancy",
"value": 9.600
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.210,1.190],
"number_observations": 2022,
"number_observations_unique": 1389,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.696
},
{
"type": "R(meas)",
"value": 0.945
},
{
"type": "R(pim)",
"value": 0.635
},
{
"type": "I/SigI",
"value": 0.500
},
{
"type": "Completeness",
"value": 43.600
},
{
"type": "Redundancy",
"value": 1.500
},
{
"type": "CC(1/2)",
"value": 0.448
}
]
},
{
"resolution_limits": [41.250,6.520],
"number_observations": 5455,
"number_observations_unique": 434,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.053
},
{
"type": "R(meas)",
"value": 0.056
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 87.100
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 12.600
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
}
]
}