Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "0ddaa1b5631bf1eb4b8e555f3a018a90",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 208.131,
"b": 112.691,
"c": 189.155,
"alpha": 90.00,
"beta": 91.49,
"gamma": 90.00
},
"wavelengths": [0.91788],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [189.091,1.909],
"number_observations": 1271688,
"number_observations_unique": 279002,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.073
},
{
"type": "R(pim)",
"value": 0.038
},
{
"type": "I/SigI",
"value": 10.0
},
{
"type": "Completeness",
"value": 95.2
},
{
"type": "Redundancy",
"value": 4.6
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.045,1.909],
"number_observations": 66905,
"number_observations_unique": 13949,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.042
},
{
"type": "R(pim)",
"value": 0.526
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "Redundancy",
"value": 4.8
},
{
"type": "CC(1/2)",
"value": 0.619
}
]
},
{
"resolution_limits": [189.091,5.563],
"number_observations": 60476,
"number_observations_unique": 13950,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.033
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 26.2
},
{
"type": "Redundancy",
"value": 4.3
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}