Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "181ef2f489cfcd072638deeca1d616c7",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 37.898,
"b": 43.111,
"c": 79.120,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91163],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.56,1.07],
"number_observations_unique": 57056,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.063
},
{
"type": "R(meas)",
"value": 0.068
},
{
"type": "R(pim)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 14.6
},
{
"type": "Completeness",
"value": 98.5
},
{
"type": "Redundancy",
"value": 12.8
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [39.56,5.86],
"number_observations_unique": 430,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.038
},
{
"type": "R(meas)",
"value": 0.042
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "Redundancy",
"value": 11.2
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
{
"resolution_limits": [1.09,1.07],
"number_observations_unique": 2600,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.145
},
{
"type": "R(meas)",
"value": 3.562
},
{
"type": "R(pim)",
"value": 1.621
},
{
"type": "Redundancy",
"value": 8.2
},
{
"type": "CC(1/2)",
"value": 0.300
}
]
}
]
}