Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "06742057d67ac7c342cc230543a187db",
"space_group_name": "P 61 2 2",
"unit_cell": {
"a": 76.760,
"b": 76.760,
"c": 222.438,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.500,2.100],
"number_observations": 436693,
"number_observations_unique": 23655,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.327
},
{
"type": "R(meas)",
"value": 0.337
},
{
"type": "R(pim)",
"value": 0.079
},
{
"type": "I/SigI",
"value": 9.200
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 18.500
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [2.160,2.100],
"number_observations": 37126,
"number_observations_unique": 1891,
"quality_factors": [
{
"type": "R(merge)",
"value": 7.849
},
{
"type": "R(meas)",
"value": 8.063
},
{
"type": "R(pim)",
"value": 1.810
},
{
"type": "I/SigI",
"value": 1.700
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 19.600
},
{
"type": "CC(1/2)",
"value": 0.757
}
]
},
{
"resolution_limits": [49.500,8.910],
"number_observations": 5502,
"number_observations_unique": 410,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.077
},
{
"type": "R(meas)",
"value": 0.080
},
{
"type": "R(pim)",
"value": 0.021
},
{
"type": "I/SigI",
"value": 24.900
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 13.400
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}