Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b1d95f050d9517c3171a872b4caf3b43",
"space_group_name": "P 63 2 2",
"unit_cell": {
"a": 153.993,
"b": 153.993,
"c": 155.200,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.73963],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.230,1.800],
"number_observations": 1825740,
"number_observations_unique": 99837,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.121
},
{
"type": "R(pim)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 22.300
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 18.300
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.830,1.800],
"number_observations": 48010,
"number_observations_unique": 4721,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.313
},
{
"type": "R(pim)",
"value": 0.427
},
{
"type": "I/SigI",
"value": 1.800
},
{
"type": "Completeness",
"value": 96.500
},
{
"type": "Redundancy",
"value": 10.200
},
{
"type": "CC(1/2)",
"value": 0.701
}
]
},
{
"resolution_limits": [48.230,9.860],
"number_observations": 12803,
"number_observations_unique": 739,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.077
},
{
"type": "R(pim)",
"value": 0.018
},
{
"type": "I/SigI",
"value": 65.400
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 17.300
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}