Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "918a0026d8264f8eb7c5042448aa0982",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 79.045,
"b": 79.045,
"c": 37.865,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.71092],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.520,1.840],
"number_observations": 31390,
"number_observations_unique": 6894,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.111
},
{
"type": "R(meas)",
"value": 0.124
},
{
"type": "R(pim)",
"value": 0.055
},
{
"type": "I/SigI",
"value": 7.000
},
{
"type": "Completeness",
"value": 63.200
},
{
"type": "Redundancy",
"value": 4.600
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [1.880,1.840],
"number_observations": 1609,
"number_observations_unique": 383,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.377
},
{
"type": "R(meas)",
"value": 1.557
},
{
"type": "R(pim)",
"value": 0.708
},
{
"type": "I/SigI",
"value": 0.700
},
{
"type": "Completeness",
"value": 57.300
},
{
"type": "Redundancy",
"value": 4.200
},
{
"type": "CC(1/2)",
"value": 0.440
}
]
},
{
"resolution_limits": [39.520,9.020],
"number_observations": 472,
"number_observations_unique": 90,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.033
},
{
"type": "R(meas)",
"value": 0.037
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 27.100
},
{
"type": "Completeness",
"value": 72.800
},
{
"type": "Redundancy",
"value": 5.200
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}