Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "25ffe698643cbd8fc3397f0a0b3f5dc8",
"space_group_name": "P 41 2 2",
"unit_cell": {
"a": 59.902,
"b": 59.902,
"c": 109.696,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [59.900,1.960],
"number_observations": 174189,
"number_observations_unique": 14992,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.198
},
{
"type": "R(meas)",
"value": 0.208
},
{
"type": "R(pim)",
"value": 0.061
},
{
"type": "I/SigI",
"value": 7.400
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 11.600
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.010,1.960],
"number_observations": 13140,
"number_observations_unique": 1078,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.595
},
{
"type": "R(meas)",
"value": 2.710
},
{
"type": "R(pim)",
"value": 0.773
},
{
"type": "I/SigI",
"value": 0.900
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 12.200
},
{
"type": "CC(1/2)",
"value": 0.667
}
]
},
{
"resolution_limits": [59.900,8.770],
"number_observations": 2344,
"number_observations_unique": 223,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.077
},
{
"type": "R(meas)",
"value": 0.081
},
{
"type": "R(pim)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 23.700
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 10.500
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}