Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3d947b3867a7906baf9f41dd44af8df1",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 113.726,
"b": 114.481,
"c": 143.903,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.01,2.55],
"number_observations_unique": 61540,
"quality_factors": [
{
"type": "I/SigI",
"value": 15.1
},
{
"type": "Completeness",
"value": 99.6
},
{
"type": "Redundancy",
"value": 4.8
}
]
},
"refln_shells": [
{
"resolution_limits": [2.690,2.550],
"number_observations": 44368,
"number_observations_unique": 8897,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.570
},
{
"type": "R(pim)",
"value": 0.282
},
{
"type": "I/SigI",
"value": 2.500
},
{
"type": "Completeness",
"value": 99.4
},
{
"type": "Redundancy",
"value": 5.000
},
{
"type": "CC(1/2)",
"value": 0.769
}
]
},
{
"resolution_limits": [48.010,8.070],
"number_observations": 9569,
"number_observations_unique": 2103,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.023
},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "I/SigI",
"value": 34.000
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 4.600
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}