Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e48b2c0d02b7fbdb1c0a5dba79f12aab",
"space_group_name": "H 3 2",
"unit_cell": {
"a": 177.666,
"b": 177.666,
"c": 246.767,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.54179],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [130.560,1.900],
"number_observations": 1290479,
"number_observations_unique": 116567,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.103
},
{
"type": "R(meas)",
"value": 0.108
},
{
"type": "R(pim)",
"value": 0.032
},
{
"type": "I/SigI",
"value": 16.700
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 11.100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.000,1.900],
"number_observations": 184377,
"number_observations_unique": 16707,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.803
},
{
"type": "R(meas)",
"value": 0.841
},
{
"type": "R(pim)",
"value": 0.248
},
{
"type": "I/SigI",
"value": 3.100
},
{
"type": "Completeness",
"value": 97.900
},
{
"type": "Redundancy",
"value": 11.000
},
{
"type": "CC(1/2)",
"value": 0.874
}
]
},
{
"resolution_limits": [130.560,6.000],
"number_observations": 41902,
"number_observations_unique": 3919,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.031
},
{
"type": "R(meas)",
"value": 0.032
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "I/SigI",
"value": 46.100
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 10.700
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}