Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "13868e534f9d52cb8c0489380ac7de86",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 57.79,
"b": 57.79,
"c": 121.99,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [25.840,1.810],
"number_observations": 1091338,
"number_observations_unique": 35952,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.464
},
{
"type": "R(pim)",
"value": 0.062
},
{
"type": "I/SigI",
"value": 13.700
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 55.600
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.850,1.810],
"number_observations": 66549,
"number_observations_unique": 1172,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.3592
},
{
"type": "R(pim)",
"value": 0.478
},
{
"type": "I/SigI",
"value": 1.800
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 56.800
},
{
"type": "CC(1/2)",
"value": 0.627
}
]
},
{
"resolution_limits": [25.840,8.870],
"number_observations": 8355,
"number_observations_unique": 214,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.069
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 46.200
},
{
"type": "Completeness",
"value": 96.600
},
{
"type": "Redundancy",
"value": 39.000
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}