Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "28bc68b784ebca97dd198a679d5cc9a7",
"space_group_name": "I 4",
"unit_cell": {
"a": 95.403,
"b": 95.403,
"c": 45.792,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92124],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [33.730,1.150],
"number_observations": 587100,
"number_observations_unique": 62299,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.040
},
{
"type": "R(meas)",
"value": 0.042
},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "I/SigI",
"value": 26.000
},
{
"type": "Completeness",
"value": 85.400
},
{
"type": "Redundancy",
"value": 9.400
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.170,1.150],
"number_observations": 449,
"number_observations_unique": 436,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.532
},
{
"type": "R(meas)",
"value": 0.752
},
{
"type": "R(pim)",
"value": 0.532
},
{
"type": "I/SigI",
"value": 0.500
},
{
"type": "Completeness",
"value": 12.300
},
{
"type": "Redundancy",
"value": 1.000
},
{
"type": "CC(1/2)",
"value": 0.622
}
]
},
{
"resolution_limits": [33.730,6.300],
"number_observations": 6134,
"number_observations_unique": 480,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.033
},
{
"type": "R(meas)",
"value": 0.035
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "I/SigI",
"value": 122.600
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 12.800
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}