Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "131459ed4a1171f3633f4beac5153756",
"space_group_name": "I 4 2 2",
"unit_cell": {
"a": 75.27,
"b": 75.27,
"c": 212.43,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97242],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.580,2.600],
"number_observations": 126067,
"number_observations_unique": 9847,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.091
},
{
"type": "R(pim)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 21.100
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 12.800
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [2.690,2.600],
"number_observations": 12722,
"number_observations_unique": 938,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.407
},
{
"type": "R(pim)",
"value": 0.699
},
{
"type": "I/SigI",
"value": 1.300
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 13.600
},
{
"type": "CC(1/2)",
"value": 0.586
}
]
},
{
"resolution_limits": [47.580,10.070],
"number_observations": 2273,
"number_observations_unique": 213,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.023
},
{
"type": "R(pim)",
"value": 0.007
},
{
"type": "I/SigI",
"value": 100.100
},
{
"type": "Completeness",
"value": 98.900
},
{
"type": "Redundancy",
"value": 10.700
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}