Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d1b89ecbed0320856367a340e95bfd8a",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 46.589,
"b": 58.418,
"c": 53.384,
"alpha": 90.00,
"beta": 96.43,
"gamma": 90.00
},
"wavelengths": [1.03361],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [28.790,1.860],
"number_observations": 79416,
"number_observations_unique": 22914,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.049
},
{
"type": "R(pim)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 17.100
},
{
"type": "Completeness",
"value": 95.400
},
{
"type": "Redundancy",
"value": 3.500
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.900,1.860],
"number_observations": 3994,
"number_observations_unique": 1290,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.588
},
{
"type": "R(pim)",
"value": 0.392
},
{
"type": "I/SigI",
"value": 2.000
},
{
"type": "Completeness",
"value": 85.200
},
{
"type": "Redundancy",
"value": 3.100
},
{
"type": "CC(1/2)",
"value": 0.690
}
]
},
{
"resolution_limits": [28.790,8.920],
"number_observations": 715,
"number_observations_unique": 211,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.022
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "I/SigI",
"value": 51.900
},
{
"type": "Completeness",
"value": 91.100
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}