Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "08581fa212f4846b98b2aeab4b96561e",
"space_group_name": "P 2 21 21",
"unit_cell": {
"a": 54.103,
"b": 85.257,
"c": 89.427,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.99998],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.810,1.850],
"number_observations_unique": 34148,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.133
},
{
"type": "R(meas)",
"value": 0.139
},
{
"type": "R(pim)",
"value": 0.039
},
{
"type": "I/SigI",
"value": 15.300
},
{
"type": "Completeness",
"value": 94.900
},
{
"type": "Redundancy",
"value": 12.600
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.890,1.850],
"number_observations_unique": 2116,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.783
},
{
"type": "R(pim)",
"value": 0.227
},
{
"type": "I/SigI",
"value": 4.000
},
{
"type": "Completeness",
"value": 98.100
},
{
"type": "Redundancy",
"value": 11.700
},
{
"type": "CC(1/2)",
"value": 0.935
}
]
},
{
"resolution_limits": [29.810,9.080],
"number_observations_unique": 356,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.069
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "I/SigI",
"value": 31.900
},
{
"type": "Completeness",
"value": 97.200
},
{
"type": "Redundancy",
"value": 10.500
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}