Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "02b4ba6af12648cf54e6fe42735848e8",
"space_group_name": "P 41 21 2",
"unit_cell": {
"a": 42.869,
"b": 42.869,
"c": 256.192,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.99990],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [256.190,1.900],
"number_observations": 530228,
"number_observations_unique": 20179,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.223
},
{
"type": "R(meas)",
"value": 0.228
},
{
"type": "R(pim)",
"value": 0.044
},
{
"type": "I/SigI",
"value": 8.800
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 26.300
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.940,1.900],
"number_observations": 34649,
"number_observations_unique": 1269,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.620
},
{
"type": "R(meas)",
"value": 2.668
},
{
"type": "R(pim)",
"value": 0.504
},
{
"type": "I/SigI",
"value": 1.200
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 27.300
},
{
"type": "CC(1/2)",
"value": 0.894
}
]
},
{
"resolution_limits": [256.190,9.110],
"number_observations": 4504,
"number_observations_unique": 270,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.046
},
{
"type": "R(meas)",
"value": 0.047
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 27.100
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 16.700
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}