Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3389e693e7e29e77134cb98cd6fc3cd0",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 46.37,
"b": 79.10,
"c": 234.34,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.96863],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [65.560,2.400],
"number_observations": 194342,
"number_observations_unique": 34791,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.133
},
{
"type": "R(pim)",
"value": 0.061
},
{
"type": "I/SigI",
"value": 7.800
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 5.600
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [2.490,2.400],
"number_observations": 20541,
"number_observations_unique": 3581,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.039
},
{
"type": "R(pim)",
"value": 0.423
},
{
"type": "I/SigI",
"value": 1.900
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 5.700
},
{
"type": "CC(1/2)",
"value": 0.351
}
]
},
{
"resolution_limits": [65.560,8.980],
"number_observations": 3936,
"number_observations_unique": 788,
"quality_factors": [
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "I/SigI",
"value": 20.500
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 5.000
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
}
]
}