Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4c425cd1db71f6d757df97ca5f0e264d",
"space_group_name": "I 21 3",
"unit_cell": {
"a": 169.168,
"b": 169.168,
"c": 169.168,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.95400],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.830,3.400],
"number_observations_unique": 11255,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.115
},
{
"type": "R(meas)",
"value": 0.117
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "I/SigI",
"value": 31.100
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 35.100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [3.670,3.400],
"number_observations_unique": 2310,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.350
},
{
"type": "R(meas)",
"value": 0.355
},
{
"type": "R(pim)",
"value": 0.058
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 36.900
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
},
{
"resolution_limits": [48.830,9.000],
"number_observations_unique": 645,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.065
},
{
"type": "R(meas)",
"value": 0.066
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 32.200
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}