Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "eaae241dc00f4eb39568d21856917ad6",
"space_group_name": "P 65 2 2",
"unit_cell": {
"a": 80.52,
"b": 80.52,
"c": 139.43,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.92819],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [69.730,1.620],
"number_observations": 661703,
"number_observations_unique": 34760,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.132
},
{
"type": "R(meas)",
"value": 0.135
},
{
"type": "R(pim)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 17.900
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 19.000
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.660,1.620],
"number_observations": 48286,
"number_observations_unique": 2500,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.182
},
{
"type": "R(meas)",
"value": 2.241
},
{
"type": "R(pim)",
"value": 0.507
},
{
"type": "I/SigI",
"value": 1.600
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 19.300
},
{
"type": "CC(1/2)",
"value": 0.517
}
]
},
{
"resolution_limits": [69.730,7.240],
"number_observations": 8217,
"number_observations_unique": 495,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.024
},
{
"type": "R(meas)",
"value": 0.024
},
{
"type": "R(pim)",
"value": 0.006
},
{
"type": "I/SigI",
"value": 83.800
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 16.600
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}