Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "db690008f670e47967d33ea97535e028",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 48.24,
"b": 72.63,
"c": 66.99,
"alpha": 90.0,
"beta": 103.0,
"gamma": 90.0
},
"wavelengths": [0.97946],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [65.27,2.200],
"number_observations": 166095,
"number_observations_unique": 21941,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.175
},
{
"type": "R(pim)",
"value": 0.068
},
{
"type": "I/SigI",
"value": 8.200
},
{
"type": "Completeness",
"value": 95.700
},
{
"type": "Redundancy",
"value": 7.600
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.270,2.200],
"number_observations": 14590,
"number_observations_unique": 1978,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.158
},
{
"type": "R(pim)",
"value": 0.843
},
{
"type": "I/SigI",
"value": 1.000
},
{
"type": "Completeness",
"value": 94.600
},
{
"type": "Redundancy",
"value": 7.400
},
{
"type": "CC(1/2)",
"value": 0.170
}
]
},
{
"resolution_limits": [47.000,8.800],
"number_observations": 2635,
"number_observations_unique": 367,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.041
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 33.800
},
{
"type": "Completeness",
"value": 95.700
},
{
"type": "Redundancy",
"value": 7.200
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}