Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "928d01263f812f0a92db929287140082",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 111.540,
"b": 27.371,
"c": 38.100,
"alpha": 90.0,
"beta": 95.8,
"gamma": 90.0
},
"wavelengths": [0.92819],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [55.480,1.180],
"number_observations": 99915,
"number_observations_unique": 36991,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.031
},
{
"type": "R(meas)",
"value": 0.037
},
{
"type": "R(pim)",
"value": 0.021
},
{
"type": "I/SigI",
"value": 14.500
},
{
"type": "Completeness",
"value": 96.100
},
{
"type": "Redundancy",
"value": 2.700
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.240,1.180],
"number_observations": 7664,
"number_observations_unique": 4615,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.246
},
{
"type": "R(meas)",
"value": 0.320
},
{
"type": "R(pim)",
"value": 0.202
},
{
"type": "I/SigI",
"value": 2.100
},
{
"type": "Completeness",
"value": 82.900
},
{
"type": "Redundancy",
"value": 1.700
},
{
"type": "CC(1/2)",
"value": 0.895
}
]
},
{
"resolution_limits": [55.480,3.720],
"number_observations": 3905,
"number_observations_unique": 1261,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.022
},
{
"type": "R(meas)",
"value": 0.026
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "I/SigI",
"value": 40.400
},
{
"type": "Completeness",
"value": 96.300
},
{
"type": "Redundancy",
"value": 3.100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}