Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "dcce134fa7861d541564e3f0bb06c534",
"space_group_name": "P 63",
"unit_cell": {
"a": 158.44,
"b": 158.44,
"c": 54.50,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97895],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.901,2.350],
"number_observations_unique": 63134,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.193
},
{
"type": "R(meas)",
"value": 0.202
},
{
"type": "R(pim)",
"value": 0.060
},
{
"type": "I/SigI",
"value": 10.900
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 11.200
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [2.410,2.350],
"number_observations": 25379,
"number_observations_unique": 2376,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.301
},
{
"type": "R(meas)",
"value": 1.368
},
{
"type": "R(pim)",
"value": 0.419
},
{
"type": "I/SigI",
"value": 2.500
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 10.700
},
{
"type": "CC(1/2)",
"value": 0.399
}
]
},
{
"resolution_limits": [44.900,10.510],
"number_observations": 4034,
"number_observations_unique": 391,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.082
},
{
"type": "R(meas)",
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},
{
"type": "R(pim)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 18.000
},
{
"type": "Completeness",
"value": 96.000
},
{
"type": "Redundancy",
"value": 10.300
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}