Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "98ca892bedf3482537c2097ea119db06",
"space_group_name": "P 21 21 2",
"unit_cell": {
"a": 54.636,
"b": 145.273,
"c": 46.801,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97933],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.050,1.680],
"number_observations": 183063,
"number_observations_unique": 43118,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.030
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 24.800
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 4.200
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.710,1.680],
"number_observations": 9541,
"number_observations_unique": 2193,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.431
},
{
"type": "R(pim)",
"value": 0.230
},
{
"type": "I/SigI",
"value": 3.400
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 4.400
},
{
"type": "CC(1/2)",
"value": 0.875
}
]
},
{
"resolution_limits": [29.050,9.050],
"number_observations": 1261,
"number_observations_unique": 329,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.016
},
{
"type": "R(pim)",
"value": 0.009
},
{
"type": "I/SigI",
"value": 69.500
},
{
"type": "Completeness",
"value": 96.700
},
{
"type": "Redundancy",
"value": 3.800
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}