Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4ecf21d8bf0856a53ec1162473ea3e54",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 76.490,
"b": 47.180,
"c": 115.698,
"alpha": 90.00,
"beta": 90.09,
"gamma": 90.00
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [115.7000,1.720],
"number_observations_unique": 82659,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.056
},
{
"type": "I/SigI",
"value": 15.700
},
{
"type": "Completeness",
"value": 94.100
},
{
"type": "Redundancy",
"value": 6.400
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.750,1.720],
"number_observations_unique": 4303,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.750
},
{
"type": "Completeness",
"value": 92.100
},
{
"type": "Redundancy",
"value": 6.300
},
{
"type": "CC(1/2)",
"value": 0.902
}
]
},
{
"resolution_limits": [63.850,9.100],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.024
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 6.900
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}