Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b77970c055d2ed2bf9ce3e648f94b971",
"space_group_name": "I 2 2 2",
"unit_cell": {
"a": 67.38,
"b": 91.52,
"c": 99.01,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97919],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [30.120,2.220],
"number_observations": 182428,
"number_observations_unique": 14405,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.186
},
{
"type": "R(meas)",
"value": 0.195
},
{
"type": "R(pim)",
"value": 0.056
},
{
"type": "I/SigI",
"value": 13.000
},
{
"type": "Completeness",
"value": 92.900
},
{
"type": "Redundancy",
"value": 12.700
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [2.280,2.220],
"number_observations": 1692,
"number_observations_unique": 253,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.407
},
{
"type": "R(meas)",
"value": 0.442
},
{
"type": "R(pim)",
"value": 0.169
},
{
"type": "I/SigI",
"value": 9.000
},
{
"type": "Completeness",
"value": 21.500
},
{
"type": "Redundancy",
"value": 6.700
},
{
"type": "CC(1/2)",
"value": 0.913
}
]
},
{
"resolution_limits": [30.120,9.930],
"number_observations": 1633,
"number_observations_unique": 195,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.034
},
{
"type": "R(meas)",
"value": 0.036
},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "I/SigI",
"value": 39.100
},
{
"type": "Completeness",
"value": 96.000
},
{
"type": "Redundancy",
"value": 8.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}