Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1c905b8b41c48b7ec9f1f09ebcedb1b8",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 71.303,
"b": 71.303,
"c": 150.180,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.350,1.450],
"number_observations": 888563,
"number_observations_unique": 69642,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.066
},
{
"type": "R(meas)",
"value": 0.069
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 23.100
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 12.800
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.470,1.450],
"number_observations": 30824,
"number_observations_unique": 3204,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.747
},
{
"type": "R(meas)",
"value": 0.788
},
{
"type": "R(pim)",
"value": 0.245
},
{
"type": "I/SigI",
"value": 2.900
},
{
"type": "Completeness",
"value": 90.800
},
{
"type": "Redundancy",
"value": 9.600
},
{
"type": "CC(1/2)",
"value": 0.858
}
]
},
{
"resolution_limits": [29.350,7.790],
"number_observations": 5866,
"number_observations_unique": 551,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.036
},
{
"type": "R(meas)",
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},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "I/SigI",
"value": 59.700
},
{
"type": "Completeness",
"value": 98.300
},
{
"type": "Redundancy",
"value": 10.600
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
}
]
}