Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "16d5f8f6d3097647812915b1d1dac369",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 49.873,
"b": 38.451,
"c": 110.059,
"alpha": 90.00,
"beta": 94.63,
"gamma": 90.00
},
"wavelengths": [0.98000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.720,1.500],
"number_observations": 458019,
"number_observations_unique": 67146,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.071
},
{
"type": "I/SigI",
"value": 13.800
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.800
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.530,1.500],
"number_observations": 22980,
"number_observations_unique": 3290,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.058
},
{
"type": "I/SigI",
"value": 1.800
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 7.000
},
{
"type": "CC(1/2)",
"value": 0.754
}
]
},
{
"resolution_limits": [46.720,8.220],
"number_observations": 2790,
"number_observations_unique": 453,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.036
},
{
"type": "I/SigI",
"value": 44.100
},
{
"type": "Completeness",
"value": 98.700
},
{
"type": "Redundancy",
"value": 6.200
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}