Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "c689efc5990a900ae1d33a1d24d8a274",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 125.725,
"b": 108.171,
"c": 75.619,
"alpha": 90.00,
"beta": 109.06,
"gamma": 90.00
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [79.993,1.828],
"number_observations": 198097,
"number_observations_unique": 57544,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.114
},
{
"type": "R(pim)",
"value": 0.061
},
{
"type": "I/SigI",
"value": 8.900
},
{
"type": "Completeness",
"value": 94.000
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.033,1.828],
"number_observations": 9926,
"number_observations_unique": 2878,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.881
},
{
"type": "R(pim)",
"value": 0.468
},
{
"type": "I/SigI",
"value": 1.600
},
{
"type": "Completeness",
"value": 72.300
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 0.612
}
]
},
{
"resolution_limits": [79.993,5.675],
"number_observations": 9617,
"number_observations_unique": 2876,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.035
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 28.100
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 3.300
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}