Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "094d864e8dbd3b4a7dd4009d4c3bd44d",
"space_group_name": "I 2 2 2",
"unit_cell": {
"a": 69.98,
"b": 108.43,
"c": 165.49,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97860],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [82.75,1.98],
"number_observations_unique": 44076,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.03546
},
{
"type": "R(meas)",
"value": 0.05014
},
{
"type": "R(pim)",
"value": 0.03546
},
{
"type": "I/SigI",
"value": 14.28
},
{
"type": "Completeness",
"value": 99.39
},
{
"type": "Redundancy",
"value": 2.0
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.05,1.98],
"number_observations_unique": 4228,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.415
},
{
"type": "R(meas)",
"value": 0.588
},
{
"type": "R(pim)",
"value": 0.415
},
{
"type": "I/SigI",
"value": 2.41
},
{
"type": "Completeness",
"value": 98.71
},
{
"type": "Redundancy",
"value": 2.0
},
{
"type": "CC(1/2)",
"value": 0.521
}
]
}
]
}