Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a4ee91432925bc77ebffc5814b330d92",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 81.788,
"b": 27.405,
"c": 56.326,
"alpha": 90.00,
"beta": 100.15,
"gamma": 90.00
},
"wavelengths": [0.92124],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [55.440,1.260],
"number_observations": 169660,
"number_observations_unique": 30824,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.083
},
{
"type": "R(meas)",
"value": 0.091
},
{
"type": "R(pim)",
"value": 0.037
},
{
"type": "I/SigI",
"value": 16.000
},
{
"type": "Completeness",
"value": 91.900
},
{
"type": "Redundancy",
"value": 5.500
},
{
"type": "CC(1/2)",
"value": 0.982
}
]
},
"refln_shells": [
{
"resolution_limits": [1.280,1.260],
"number_observations": 1816,
"number_observations_unique": 843,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.260
},
{
"type": "R(meas)",
"value": 1.723
},
{
"type": "R(pim)",
"value": 1.166
},
{
"type": "I/SigI",
"value": 2.000
},
{
"type": "Completeness",
"value": 50.900
},
{
"type": "Redundancy",
"value": 2.200
},
{
"type": "CC(1/2)",
"value": 0.218
}
]
},
{
"resolution_limits": [55.440,6.790],
"number_observations": 1435,
"number_observations_unique": 249,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.079
},
{
"type": "R(meas)",
"value": 0.088
},
{
"type": "R(pim)",
"value": 0.038
},
{
"type": "I/SigI",
"value": 36.700
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 5.800
},
{
"type": "CC(1/2)",
"value": 0.986
}
]
}
]
}