Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6edd13bb8d24f6efe70b1b2bfbfdbade",
"space_group_name": "P 21 21 2",
"unit_cell": {
"a": 117.864,
"b": 169.989,
"c": 125.662,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.430,2.200],
"number_observations": 869801,
"number_observations_unique": 126857,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.153
},
{
"type": "I/SigI",
"value": 10.700
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 6.900
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.240,2.200],
"number_observations": 43981,
"number_observations_unique": 6185,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.212
},
{
"type": "I/SigI",
"value": 2.100
},
{
"type": "Completeness",
"value": 98.300
},
{
"type": "Redundancy",
"value": 7.100
},
{
"type": "CC(1/2)",
"value": 0.772
}
]
},
{
"resolution_limits": [48.430,12.050],
"number_observations": 5393,
"number_observations_unique": 876,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.037
},
{
"type": "I/SigI",
"value": 36.100
},
{
"type": "Completeness",
"value": 97.500
},
{
"type": "Redundancy",
"value": 6.200
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}