Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4809ff72e03688fcff5c722271fc9743",
"space_group_name": "P 41 2 2",
"unit_cell": {
"a": 50.541,
"b": 50.541,
"c": 153.152,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.510,1.730],
"number_observations": 174727,
"number_observations_unique": 20449,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.094
},
{
"type": "R(meas)",
"value": 0.100
},
{
"type": "R(pim)",
"value": 0.033
},
{
"type": "I/SigI",
"value": 11.200
},
{
"type": "Completeness",
"value": 95.500
},
{
"type": "Redundancy",
"value": 8.500
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.770,1.730],
"number_observations": 11273,
"number_observations_unique": 1509,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.003
},
{
"type": "R(meas)",
"value": 3.216
},
{
"type": "R(pim)",
"value": 1.113
},
{
"type": "I/SigI",
"value": 1.000
},
{
"type": "Completeness",
"value": 97.700
},
{
"type": "Redundancy",
"value": 7.500
},
{
"type": "CC(1/2)",
"value": 0.497
}
]
},
{
"resolution_limits": [50.510,7.740],
"number_observations": 2170,
"number_observations_unique": 269,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.026
},
{
"type": "R(meas)",
"value": 0.028
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "I/SigI",
"value": 46.300
},
{
"type": "Completeness",
"value": 90.200
},
{
"type": "Redundancy",
"value": 8.100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}