Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "5054261950213f5c4c00d9f35c8f1299",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 68.372,
"b": 68.372,
"c": 214.014,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.95360],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [59.210,2.060],
"number_observations": 734925,
"number_observations_unique": 36969,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.223
},
{
"type": "R(meas)",
"value": 0.229
},
{
"type": "R(pim)",
"value": 0.051
},
{
"type": "I/SigI",
"value": 8.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 19.900
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.120,2.060],
"number_observations": 55437,
"number_observations_unique": 2809,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.434
},
{
"type": "R(meas)",
"value": 3.525
},
{
"type": "R(pim)",
"value": 0.790
},
{
"type": "I/SigI",
"value": 1.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 19.700
},
{
"type": "CC(1/2)",
"value": 0.390
}
]
},
{
"resolution_limits": [59.210,8.980],
"number_observations": 9138,
"number_observations_unique": 546,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.060
},
{
"type": "R(meas)",
"value": 0.062
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "I/SigI",
"value": 21.700
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 16.700
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}