Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f3c5c6a2998e9f4942ba2878d38d6b02",
"space_group_name": "P 64",
"unit_cell": {
"a": 133.29,
"b": 133.29,
"c": 81.76,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.07800],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [66.710,2.600],
"number_observations": 459637,
"number_observations_unique": 25648,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.148
},
{
"type": "R(meas)",
"value": 0.153
},
{
"type": "R(pim)",
"value": 0.036
},
{
"type": "I/SigI",
"value": 12.200
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 17.900
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.670,2.600],
"number_observations": 34900,
"number_observations_unique": 1903,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.177
},
{
"type": "R(meas)",
"value": 1.211
},
{
"type": "R(pim)",
"value": 0.281
},
{
"type": "I/SigI",
"value": 2.700
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 18.300
},
{
"type": "CC(1/2)",
"value": 0.642
}
]
},
{
"resolution_limits": [66.710,11.630],
"number_observations": 4826,
"number_observations_unique": 307,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.043
},
{
"type": "R(meas)",
"value": 0.045
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 27.600
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 15.700
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}