Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "aac798ce4a8662f08059a73ec76f8a6d",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.779,
"b": 88.779,
"c": 39.442,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.88557],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.390,0.990],
"number_observations": 1058705,
"number_observations_unique": 170513,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.064
},
{
"type": "R(meas)",
"value": 0.070
},
{
"type": "R(pim)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 10.100
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 6.200
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.010,0.990],
"number_observations": 28757,
"number_observations_unique": 8083,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.948
},
{
"type": "R(meas)",
"value": 2.277
},
{
"type": "R(pim)",
"value": 1.137
},
{
"type": "I/SigI",
"value": 0.400
},
{
"type": "Completeness",
"value": 96.500
},
{
"type": "Redundancy",
"value": 3.600
},
{
"type": "CC(1/2)",
"value": 0.306
}
]
},
{
"resolution_limits": [44.390,5.420],
"number_observations": 7748,
"number_observations_unique": 1132,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.031
},
{
"type": "R(meas)",
"value": 0.033
},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "I/SigI",
"value": 40.100
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.800
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}