Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "31cc9380ea424674effb270f718a3bac",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.797,
"b": 88.797,
"c": 39.592,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.77488],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.400,0.980],
"number_observations": 1190981,
"number_observations_unique": 175850,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.066
},
{
"type": "R(meas)",
"value": 0.071
},
{
"type": "R(pim)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 10.900
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 6.800
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.000,0.980],
"number_observations": 57485,
"number_observations_unique": 8577,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.097
},
{
"type": "R(meas)",
"value": 2.274
},
{
"type": "R(pim)",
"value": 0.869
},
{
"type": "I/SigI",
"value": 0.600
},
{
"type": "Completeness",
"value": 98.100
},
{
"type": "Redundancy",
"value": 6.700
},
{
"type": "CC(1/2)",
"value": 0.451
}
]
},
{
"resolution_limits": [44.400,5.370],
"number_observations": 7652,
"number_observations_unique": 1150,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.049
},
{
"type": "R(meas)",
"value": 0.054
},
{
"type": "R(pim)",
"value": 0.021
},
{
"type": "I/SigI",
"value": 32.700
},
{
"type": "Completeness",
"value": 98.900
},
{
"type": "Redundancy",
"value": 6.700
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
}
]
}