Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "941e3f7abd2c6f1d8572c4c4d7fe8fa1",
"space_group_name": "P 2 21 21",
"unit_cell": {
"a": 42.229,
"b": 123.997,
"c": 176.200,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.05,1.81],
"number_observations_unique": 84661,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.0295
},
{
"type": "R(pim)",
"value": 0.0295
},
{
"type": "I/SigI",
"value": 14.09
},
{
"type": "Completeness",
"value": 99.98
},
{
"type": "Redundancy",
"value": 2
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.875,1.81],
"number_observations_unique": 8438,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.2867
},
{
"type": "R(pim)",
"value": 0.878
},
{
"type": "I/SigI",
"value": 2.62
},
{
"type": "CC(1/2)",
"value": 0.878
}
]
}
]
}