Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3a20969660822e26505d0506186984b1",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.782,
"b": 88.782,
"c": 39.417,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.88557],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.390,1.010],
"number_observations": 1019642,
"number_observations_unique": 160152,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.085
},
{
"type": "R(meas)",
"value": 0.093
},
{
"type": "R(pim)",
"value": 0.036
},
{
"type": "I/SigI",
"value": 7.500
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 6.400
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.030,1.010],
"number_observations": 36569,
"number_observations_unique": 7328,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.030
},
{
"type": "R(meas)",
"value": 3.377
},
{
"type": "R(pim)",
"value": 1.458
},
{
"type": "I/SigI",
"value": 0.300
},
{
"type": "Completeness",
"value": 92.900
},
{
"type": "Redundancy",
"value": 5.000
},
{
"type": "CC(1/2)",
"value": 0.293
}
]
},
{
"resolution_limits": [44.390,5.530],
"number_observations": 7234,
"number_observations_unique": 1066,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.040
},
{
"type": "R(meas)",
"value": 0.043
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 30.200
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.800
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}