Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8750b47f9a1c52a49dabc8c5e9eb12ff",
"space_group_name": "P 65",
"unit_cell": {
"a": 104.31,
"b": 104.31,
"c": 139.13,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.93220],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [69.590,2.800],
"number_observations": 128219,
"number_observations_unique": 21172,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.049
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 24.000
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.100
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.990,2.800],
"number_observations": 23753,
"number_observations_unique": 3840,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.330
},
{
"type": "R(pim)",
"value": 0.145
},
{
"type": "I/SigI",
"value": 5.500
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.200
},
{
"type": "CC(1/2)",
"value": 0.950
}
]
},
{
"resolution_limits": [69.590,7.920],
"number_observations": 5295,
"number_observations_unique": 935,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.021
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "I/SigI",
"value": 55.300
},
{
"type": "Completeness",
"value": 96.700
},
{
"type": "Redundancy",
"value": 5.700
},
{
"type": "CC(1/2)",
"value": 0.990
}
]
}
]
}