Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4f5f9e364c6e6af078e0894dbd922677",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 50.212,
"b": 75.383,
"c": 68.347,
"alpha": 90.00,
"beta": 111.55,
"gamma": 90.00
},
"wavelengths": [0.91840],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.70,1.77],
"number_observations_unique": 44182,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.061
},
{
"type": "R(pim)",
"value": 0.055
},
{
"type": "I/SigI",
"value": 11.7
},
{
"type": "Completeness",
"value": 95.5
},
{
"type": "Redundancy",
"value": 2.8
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.80,1.77],
"number_observations_unique": 1426,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.434
},
{
"type": "R(pim)",
"value": 0.322
},
{
"type": "I/SigI",
"value": 2.4
},
{
"type": "Completeness",
"value": 54.0
},
{
"type": "Redundancy",
"value": 2.7
},
{
"type": "CC(1/2)",
"value": 0.840
}
]
}
]
}