Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a7b05e06bb1d54fd1958151152c6e647",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 110.201,
"b": 120.412,
"c": 264.318,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [19.850,1.8995],
"number_observations": 972879,
"number_observations_unique": 269523,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.079
},
{
"type": "R(pim)",
"value": 0.048
},
{
"type": "I/SigI",
"value": 13.500
},
{
"type": "Completeness",
"value": 98.000
},
{
"type": "Redundancy",
"value": 3.600
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.930,1.8995],
"number_observations": 31434,
"number_observations_unique": 11590,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.590
},
{
"type": "R(pim)",
"value": 0.400
},
{
"type": "I/SigI",
"value": 1.900
},
{
"type": "Completeness",
"value": 86.600
},
{
"type": "Redundancy",
"value": 2.700
},
{
"type": "CC(1/2)",
"value": 0.641
}
]
},
{
"resolution_limits": [19.850,10.410],
"number_observations": 5048,
"number_observations_unique": 1582,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.026
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 40.000
},
{
"type": "Completeness",
"value": 85.100
},
{
"type": "Redundancy",
"value": 3.200
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}