Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6cbdfcd4870bdff9171d33115d27336c",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 59.785,
"b": 76.094,
"c": 124.432,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [53.890,1.300],
"number_observations": 1829452,
"number_observations_unique": 139784,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.073
},
{
"type": "R(meas)",
"value": 0.076
},
{
"type": "R(pim)",
"value": 0.021
},
{
"type": "I/SigI",
"value": 14.900
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 13.100
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.320,1.300],
"number_observations": 72198,
"number_observations_unique": 6775,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.317
},
{
"type": "R(meas)",
"value": 1.385
},
{
"type": "R(pim)",
"value": 0.421
},
{
"type": "I/SigI",
"value": 1.300
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 10.700
},
{
"type": "CC(1/2)",
"value": 0.851
}
]
},
{
"resolution_limits": [53.890,7.120],
"number_observations": 11032,
"number_observations_unique": 994,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.061
},
{
"type": "R(meas)",
"value": 0.064
},
{
"type": "R(pim)",
"value": 0.021
},
{
"type": "I/SigI",
"value": 37.400
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 11.100
},
{
"type": "CC(1/2)",
"value": 0.980
}
]
}
]
}