Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "313f4442afd0571c01f55a11a3eab06d",
"space_group_name": "P 1",
"unit_cell": {
"a": 40.51,
"b": 40.60,
"c": 202.38,
"alpha": 90.07,
"beta": 93.11,
"gamma": 119.75
},
"wavelengths": [1.54180],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [35.100,2.550],
"number_observations": 198905,
"number_observations_unique": 36264,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.051
},
{
"type": "R(meas)",
"value": 0.056
},
{
"type": "R(pim)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 17.300
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 5.500
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.660,2.550],
"number_observations": 24444,
"number_observations_unique": 4386,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.960
},
{
"type": "R(meas)",
"value": 1.061
},
{
"type": "R(pim)",
"value": 0.448
},
{
"type": "I/SigI",
"value": 1.800
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 5.600
},
{
"type": "CC(1/2)",
"value": 0.591
}
]
},
{
"resolution_limits": [35.100,8.830],
"number_observations": 4405,
"number_observations_unique": 853,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.037
},
{
"type": "R(meas)",
"value": 0.041
},
{
"type": "R(pim)",
"value": 0.018
},
{
"type": "I/SigI",
"value": 38.500
},
{
"type": "Completeness",
"value": 96.900
},
{
"type": "Redundancy",
"value": 5.200
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}