Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "262392b9728df34a05ca8431e4647997",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 62.34,
"b": 91.54,
"c": 69.39,
"alpha": 90.00,
"beta": 112.51,
"gamma": 90.00
},
"wavelengths": [1.54180],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.750,1.900],
"number_observations": 252521,
"number_observations_unique": 53435,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.085
},
{
"type": "R(meas)",
"value": 0.096
},
{
"type": "R(pim)",
"value": 0.043
},
{
"type": "I/SigI",
"value": 10.600
},
{
"type": "Completeness",
"value": 94.500
},
{
"type": "Redundancy",
"value": 4.700
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [1.940,1.900],
"number_observations": 14977,
"number_observations_unique": 3258,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.431
},
{
"type": "R(meas)",
"value": 0.485
},
{
"type": "R(pim)",
"value": 0.219
},
{
"type": "I/SigI",
"value": 2.800
},
{
"type": "Completeness",
"value": 89.300
},
{
"type": "Redundancy",
"value": 4.600
},
{
"type": "CC(1/2)",
"value": 0.891
}
]
},
{
"resolution_limits": [48.750,9.110],
"number_observations": 2442,
"number_observations_unique": 535,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.065
},
{
"type": "R(meas)",
"value": 0.074
},
{
"type": "R(pim)",
"value": 0.035
},
{
"type": "I/SigI",
"value": 19.300
},
{
"type": "Completeness",
"value": 98.700
},
{
"type": "Redundancy",
"value": 4.600
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
}
]
}