Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1fe031a4b7aab750fd8630d46178b031",
"space_group_name": "P 61 2 2",
"unit_cell": {
"a": 57.824,
"b": 57.824,
"c": 395.675,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [197.840,1.670],
"number_observations": 852447,
"number_observations_unique": 47553,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.180
},
{
"type": "R(meas)",
"value": 0.186
},
{
"type": "R(pim)",
"value": 0.044
},
{
"type": "I/SigI",
"value": 10.500
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 17.900
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.710,1.670],
"number_observations": 52843,
"number_observations_unique": 3406,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.838
},
{
"type": "R(meas)",
"value": 2.934
},
{
"type": "R(pim)",
"value": 0.738
},
{
"type": "I/SigI",
"value": 1.200
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 15.500
},
{
"type": "CC(1/2)",
"value": 0.654
}
]
},
{
"resolution_limits": [197.840,7.470],
"number_observations": 10381,
"number_observations_unique": 730,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.044
},
{
"type": "R(meas)",
"value": 0.046
},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "I/SigI",
"value": 32.800
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 14.200
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}