Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e4a3095e901f74bdf87be4432d31507a",
"space_group_name": "P 61 2 2",
"unit_cell": {
"a": 242.93,
"b": 242.93,
"c": 135.51,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97915],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,2.700],
"number_observations_unique": 122616,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.309
},
{
"type": "R(meas)",
"value": 0.317
},
{
"type": "R(pim)",
"value": 0.070
},
{
"type": "I/SigI",
"value": 11.100
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 19.800
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [2.770,2.700],
"number_observations": 84999,
"number_observations_unique": 4478,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.713
},
{
"type": "R(meas)",
"value": 2.787
},
{
"type": "R(pim)",
"value": 0.635
},
{
"type": "I/SigI",
"value": 1.200
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 19.000
},
{
"type": "CC(1/2)",
"value": 0.502
}
]
},
{
"resolution_limits": [19.920,12.370],
"number_observations": 10600,
"number_observations_unique": 588,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.043
},
{
"type": "R(meas)",
"value": 0.044
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "I/SigI",
"value": 49.600
},
{
"type": "Completeness",
"value": 76.400
},
{
"type": "Redundancy",
"value": 18.000
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}