Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "be7347e5875c5e92c1459bd2b3c05618",
"space_group_name": "I 41 2 2",
"unit_cell": {
"a": 57.684,
"b": 57.684,
"c": 184.193,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [37.290,1.300],
"number_observations": 517549,
"number_observations_unique": 38785,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.071
},
{
"type": "R(meas)",
"value": 0.074
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "I/SigI",
"value": 19.200
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 13.300
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.320,1.300],
"number_observations": 23826,
"number_observations_unique": 1888,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.447
},
{
"type": "R(meas)",
"value": 1.509
},
{
"type": "R(pim)",
"value": 0.421
},
{
"type": "I/SigI",
"value": 1.500
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 12.600
},
{
"type": "CC(1/2)",
"value": 0.792
}
]
},
{
"resolution_limits": [37.290,7.120],
"number_observations": 3508,
"number_observations_unique": 300,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.046
},
{
"type": "R(meas)",
"value": 0.048
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 49.500
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 11.700
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}