Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4cb6e732f30114b1a0427c253d3385fb",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 39.296,
"b": 101.048,
"c": 52.109,
"alpha": 90.00,
"beta": 101.03,
"gamma": 90.00
},
"wavelengths": [0.96860],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [45.63,1.60],
"number_observations_unique": 51683,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.112
},
{
"type": "R(pim)",
"value": 0.089
},
{
"type": "I/SigI",
"value": 6.7
},
{
"type": "Completeness",
"value": 98.4
},
{
"type": "Redundancy",
"value": 3.7
},
{
"type": "CC(1/2)",
"value": 0.961
}
]
},
"refln_shells": [
{
"resolution_limits": [1.63,1.60],
"number_observations_unique": 2575,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.661
},
{
"type": "R(pim)",
"value": 0.538
},
{
"type": "I/SigI",
"value": 1.8
},
{
"type": "Completeness",
"value": 98.4
},
{
"type": "Redundancy",
"value": 3.7
},
{
"type": "CC(1/2)",
"value": 0.498
}
]
}
]
}