Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "52d1ca3b112c0c4a58e6c1b3b83b4603",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 67.254,
"b": 127.103,
"c": 144.080,
"alpha": 90.00,
"beta": 103.43,
"gamma": 90.00
},
"wavelengths": [0.96860,1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [70.07,4.50],
"number_observations_unique": 13858,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.226
},
{
"type": "I/SigI",
"value": 4.0
},
{
"type": "Completeness",
"value": 98.9
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.960
}
]
},
"refln_shells": [
{
"resolution_limits": [4.67,4.50],
"number_observations_unique": 1273,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.907
},
{
"type": "Completeness",
"value": 98
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.594
}
]
}
]
}