Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "c107e11bc73e439d2a9b5a26e38f6242",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 55.988,
"b": 56.155,
"c": 101.254,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [28.930,2.180],
"number_observations": 108133,
"number_observations_unique": 17139,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.096
},
{
"type": "R(meas)",
"value": 0.105
},
{
"type": "R(pim)",
"value": 0.043
},
{
"type": "I/SigI",
"value": 17.700
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 6.300
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [2.240,2.180],
"number_observations": 6471,
"number_observations_unique": 1208,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.181
},
{
"type": "R(meas)",
"value": 1.315
},
{
"type": "R(pim)",
"value": 0.568
},
{
"type": "I/SigI",
"value": 1.100
},
{
"type": "Completeness",
"value": 95.600
},
{
"type": "Redundancy",
"value": 5.400
},
{
"type": "CC(1/2)",
"value": 0.952
}
]
},
{
"resolution_limits": [28.930,9.750],
"number_observations": 1368,
"number_observations_unique": 233,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.028
},
{
"type": "R(meas)",
"value": 0.031
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 43.800
},
{
"type": "Completeness",
"value": 96.700
},
{
"type": "Redundancy",
"value": 5.900
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}