Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "50b09c325044511e065435c3b7c36e4c",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 75.808,
"b": 80.526,
"c": 180.709,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.00,2.88],
"number_observations_unique": 24658,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.195
},
{
"type": "R(meas)",
"value": 0.215
},
{
"type": "R(pim)",
"value": 0.086
},
{
"type": "I/SigI",
"value": 3.9
},
{
"type": "Completeness",
"value": 95.1
},
{
"type": "Redundancy",
"value": 5.0
},
{
"type": "CC(1/2)",
"value": 0.934
}
]
},
"refln_shells": [
{
"resolution_limits": [3.00,2.90],
"number_observations_unique": 2234,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.321
},
{
"type": "R(meas)",
"value": 0.384
},
{
"type": "R(pim)",
"value": 0.205
},
{
"type": "Completeness",
"value": 87.5
},
{
"type": "Redundancy",
"value": 2.8
},
{
"type": "CC(1/2)",
"value": 0.618
}
]
},
{
"resolution_limits": [3.12,3.00],
"number_observations_unique": 2347,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.308
},
{
"type": "R(meas)",
"value": 0.357
},
{
"type": "R(pim)",
"value": 0.173
},
{
"type": "Completeness",
"value": 92.5
},
{
"type": "Redundancy",
"value": 3.6
},
{
"type": "CC(1/2)",
"value": 0.687
}
]
},
{
"resolution_limits": [3.27,3.12],
"number_observations_unique": 2392,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.297
},
{
"type": "R(meas)",
"value": 0.337
},
{
"type": "R(pim)",
"value": 0.153
},
{
"type": "Completeness",
"value": 93.9
},
{
"type": "Redundancy",
"value": 4.0
},
{
"type": "CC(1/2)",
"value": 0.775
}
]
},
{
"resolution_limits": [3.44,3.27],
"number_observations_unique": 2427,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.278
},
{
"type": "R(meas)",
"value": 0.314
},
{
"type": "R(pim)",
"value": 0.142
},
{
"type": "Completeness",
"value": 94.8
},
{
"type": "Redundancy",
"value": 4.2
},
{
"type": "CC(1/2)",
"value": 0.831
}
]
},
{
"resolution_limits": [3.65,3.44],
"number_observations_unique": 2440,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.244
},
{
"type": "R(meas)",
"value": 0.273
},
{
"type": "R(pim)",
"value": 0.116
},
{
"type": "Completeness",
"value": 95.8
},
{
"type": "Redundancy",
"value": 4.6
},
{
"type": "CC(1/2)",
"value": 0.917
}
]
},
{
"resolution_limits": [3.94,3.65],
"number_observations_unique": 2462,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.226
},
{
"type": "R(meas)",
"value": 0.252
},
{
"type": "R(pim)",
"value": 0.109
},
{
"type": "Completeness",
"value": 95.8
},
{
"type": "Redundancy",
"value": 4.6
},
{
"type": "CC(1/2)",
"value": 0.900
}
]
},
{
"resolution_limits": [4.33,3.94],
"number_observations_unique": 2526,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.199
},
{
"type": "R(meas)",
"value": 0.217
},
{
"type": "R(pim)",
"value": 0.084
},
{
"type": "Completeness",
"value": 97.8
},
{
"type": "Redundancy",
"value": 5.9
},
{
"type": "CC(1/2)",
"value": 0.961
}
]
},
{
"resolution_limits": [4.96,4.33],
"number_observations_unique": 2537,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.183
},
{
"type": "R(meas)",
"value": 0.198
},
{
"type": "R(pim)",
"value": 0.073
},
{
"type": "Completeness",
"value": 97.9
},
{
"type": "Redundancy",
"value": 6.4
},
{
"type": "CC(1/2)",
"value": 0.971
}
]
},
{
"resolution_limits": [6.24,4.96],
"number_observations_unique": 2562,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.191
},
{
"type": "R(meas)",
"value": 0.207
},
{
"type": "R(pim)",
"value": 0.078
},
{
"type": "Completeness",
"value": 96.9
},
{
"type": "Redundancy",
"value": 6.1
},
{
"type": "CC(1/2)",
"value": 0.976
}
]
},
{
"resolution_limits": [6.74,6.24],
"number_observations_unique": 2704,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.139
},
{
"type": "R(meas)",
"value": 0.149
},
{
"type": "R(pim)",
"value": 0.052
},
{
"type": "Completeness",
"value": 97.4
},
{
"type": "Redundancy",
"value": 7.5
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
}
]
}