Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "659659beb08f89336696bafd7dcbdc8f",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 268.88,
"b": 59.94,
"c": 144.45,
"alpha": 90.00,
"beta": 116.51,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [120.310,2.980],
"number_observations": 106198,
"number_observations_unique": 41141,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.054
},
{
"type": "R(pim)",
"value": 0.038
},
{
"type": "I/SigI",
"value": 14.300
},
{
"type": "Completeness",
"value": 96.200
},
{
"type": "Redundancy",
"value": 2.600
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [4.210,2.980],
"number_observations": 59218,
"number_observations_unique": 26085,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.113
},
{
"type": "R(pim)",
"value": 0.086
},
{
"type": "I/SigI",
"value": 7.500
},
{
"type": "Completeness",
"value": 95.200
},
{
"type": "Redundancy",
"value": 2.300
},
{
"type": "CC(1/2)",
"value": 0.985
}
]
},
{
"resolution_limits": [120.310,4.210],
"number_observations": 46980,
"number_observations_unique": 15056,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.036
},
{
"type": "R(pim)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 26.100
},
{
"type": "Completeness",
"value": 97.900
},
{
"type": "Redundancy",
"value": 3.100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}