Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "21c847a06c39c97d71b1d56898ce8eaa",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.360,
"b": 88.360,
"c": 39.153,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91257],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [88.350,1.120],
"number_observations": 652875,
"number_observations_unique": 115016,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.089
},
{
"type": "R(meas)",
"value": 0.097
},
{
"type": "R(pim)",
"value": 0.039
},
{
"type": "I/SigI",
"value": 5.400
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 5.700
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.140,1.120],
"number_observations": 20456,
"number_observations_unique": 5455,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.967
},
{
"type": "R(meas)",
"value": 2.290
},
{
"type": "R(pim)",
"value": 1.132
},
{
"type": "I/SigI",
"value": 0.200
},
{
"type": "Completeness",
"value": 95.900
},
{
"type": "Redundancy",
"value": 3.700
},
{
"type": "CC(1/2)",
"value": 0.365
}
]
},
{
"resolution_limits": [88.350,6.140],
"number_observations": 5192,
"number_observations_unique": 782,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.053
},
{
"type": "R(meas)",
"value": 0.058
},
{
"type": "R(pim)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 22.000
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.600
},
{
"type": "CC(1/2)",
"value": 0.987
}
]
}
]
}