Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b407c111483573a11a887aedb3f2a005",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 44.855,
"b": 119.835,
"c": 60.569,
"alpha": 90.00,
"beta": 111.21,
"gamma": 90.00
},
"wavelengths": [1.12710],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [120.32,1.74],
"number_observations_unique": 58703,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.115
},
{
"type": "R(pim)",
"value": 0.125
},
{
"type": "I/SigI",
"value": 9.8
},
{
"type": "Completeness",
"value": 97.15
},
{
"type": "Redundancy",
"value": 6.67
},
{
"type": "CC(1/2)",
"value": 0.982
}
]
},
"refln_shells": [
{
"resolution_limits": [1.78,1.75],
"number_observations_unique": 2297,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.989
},
{
"type": "R(meas)",
"value": 1.098
},
{
"type": "R(pim)",
"value": 0.462
},
{
"type": "I/SigI",
"value": 0.9
},
{
"type": "Completeness",
"value": 76.69
},
{
"type": "Redundancy",
"value": 5.21
},
{
"type": "CC(1/2)",
"value": 0.676
}
]
}
]
}