Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a31f5eea0bf48b8d1e50b48dc92ee5cb",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 71.626,
"b": 71.626,
"c": 197.065,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92124],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [67.320,2.050],
"number_observations": 871788,
"number_observations_unique": 33118,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.644
},
{
"type": "R(meas)",
"value": 0.656
},
{
"type": "R(pim)",
"value": 0.126
},
{
"type": "I/SigI",
"value": 6.300
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 26.300
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
},
"refln_shells": [
{
"resolution_limits": [2.160,2.050],
"number_observations": 130925,
"number_observations_unique": 4728,
"quality_factors": [
{
"type": "R(merge)",
"value": 7.101
},
{
"type": "R(meas)",
"value": 7.232
},
{
"type": "R(pim)",
"value": 1.362
},
{
"type": "I/SigI",
"value": 0.700
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 27.700
},
{
"type": "CC(1/2)",
"value": 0.405
}
]
},
{
"resolution_limits": [67.320,6.490],
"number_observations": 26841,
"number_observations_unique": 1223,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.097
},
{
"type": "R(meas)",
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},
{
"type": "R(pim)",
"value": 0.021
},
{
"type": "I/SigI",
"value": 22.200
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 21.900
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}