Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "32b74c2a5eda01a5aa915ac806a9d7aa",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.734,
"b": 88.734,
"c": 39.526,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.88557],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.370,0.990],
"number_observations": 1061007,
"number_observations_unique": 170242,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.069
},
{
"type": "R(meas)",
"value": 0.075
},
{
"type": "R(pim)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 9.700
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 6.200
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.010,0.990],
"number_observations": 32753,
"number_observations_unique": 7733,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.242
},
{
"type": "R(meas)",
"value": 1.414
},
{
"type": "R(pim)",
"value": 0.659
},
{
"type": "I/SigI",
"value": 0.600
},
{
"type": "Completeness",
"value": 91.900
},
{
"type": "Redundancy",
"value": 4.200
},
{
"type": "CC(1/2)",
"value": 0.617
}
]
},
{
"resolution_limits": [44.370,5.420],
"number_observations": 7713,
"number_observations_unique": 1134,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.036
},
{
"type": "R(meas)",
"value": 0.039
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "I/SigI",
"value": 32.300
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.800
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}