Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "c4bebe45a81c6390aa688418115416da",
"space_group_name": "I 4",
"unit_cell": {
"a": 95.459,
"b": 95.459,
"c": 45.730,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92134],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [67.500,1.320],
"number_observations": 554419,
"number_observations_unique": 48226,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.094
},
{
"type": "R(meas)",
"value": 0.098
},
{
"type": "R(pim)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 17.600
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 11.500
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.340,1.320],
"number_observations": 10646,
"number_observations_unique": 2280,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.926
},
{
"type": "R(meas)",
"value": 2.177
},
{
"type": "R(pim)",
"value": 0.980
},
{
"type": "I/SigI",
"value": 1.100
},
{
"type": "Completeness",
"value": 95.300
},
{
"type": "Redundancy",
"value": 4.700
},
{
"type": "CC(1/2)",
"value": 0.264
}
]
},
{
"resolution_limits": [67.500,7.230],
"number_observations": 3950,
"number_observations_unique": 327,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.055
},
{
"type": "R(meas)",
"value": 0.058
},
{
"type": "R(pim)",
"value": 0.018
},
{
"type": "I/SigI",
"value": 64.700
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 12.100
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}