Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e400c33066d66b5825fcaf8ccf505806",
"space_group_name": "P 1 2 1",
"unit_cell": {
"a": 29.856,
"b": 23.647,
"c": 31.052,
"alpha": 90.00,
"beta": 107.59,
"gamma": 90.00
},
"wavelengths": [1.77120,3.35090],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.600,1.74],
"number_observations_unique": 4377,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.021
},
{
"type": "I/SigI",
"value": 15.6
},
{
"type": "Completeness",
"value": 99.5
},
{
"type": "Redundancy",
"value": 6.24
},
{
"type": "CC(1/2)",
"value": 1
}
]
},
"refln_shells": [
{
"resolution_limits": [1.80,1.74],
"number_observations_unique": 431,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.34
},
{
"type": "I/SigI",
"value": 1.76
},
{
"type": "Completeness",
"value": 98.6
},
{
"type": "CC(1/2)",
"value": 0.842
}
]
},
{
"resolution_limits": [2.31,2.19],
"number_observations_unique": 254,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.338
},
{
"type": "I/SigI",
"value": 3.8
},
{
"type": "CC(1/2)",
"value": 0.915
}
]
}
]
}