Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "14ca27cf8090a542d555db44cbc719ee",
"space_group_name": "I 4",
"unit_cell": {
"a": 95.400,
"b": 95.400,
"c": 45.739,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92134],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [67.450,1.300],
"number_observations": 560400,
"number_observations_unique": 49717,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.063
},
{
"type": "R(meas)",
"value": 0.066
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 19.200
},
{
"type": "Completeness",
"value": 98.200
},
{
"type": "Redundancy",
"value": 11.300
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.320,1.300],
"number_observations": 9205,
"number_observations_unique": 2065,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.240
},
{
"type": "R(meas)",
"value": 1.419
},
{
"type": "R(pim)",
"value": 0.663
},
{
"type": "I/SigI",
"value": 0.500
},
{
"type": "Completeness",
"value": 83.300
},
{
"type": "Redundancy",
"value": 4.500
},
{
"type": "CC(1/2)",
"value": 0.328
}
]
},
{
"resolution_limits": [67.450,7.120],
"number_observations": 4150,
"number_observations_unique": 341,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.031
},
{
"type": "R(meas)",
"value": 0.033
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "I/SigI",
"value": 112.700
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 12.200
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}