Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9a76e4346681ac28ecf4d6ebba019d55",
"space_group_name": "P 65 2 2",
"unit_cell": {
"a": 216.190,
"b": 216.190,
"c": 318.767,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [159.380,2.200],
"number_observations": 1289710,
"number_observations_unique": 219305,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.138
},
{
"type": "R(pim)",
"value": 0.060
},
{
"type": "I/SigI",
"value": 10.000
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 5.900
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [2.240,2.200],
"number_observations": 62163,
"number_observations_unique": 10755,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.864
},
{
"type": "R(pim)",
"value": 0.388
},
{
"type": "I/SigI",
"value": 2.100
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 5.800
},
{
"type": "CC(1/2)",
"value": 0.715
}
]
},
{
"resolution_limits": [159.380,12.050],
"number_observations": 8064,
"number_observations_unique": 1457,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.025
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 24.800
},
{
"type": "Completeness",
"value": 94.400
},
{
"type": "Redundancy",
"value": 5.500
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}