Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "798c19be58fe3fba11b404bc973b0e26",
"space_group_name": "P 41 21 2",
"unit_cell": {
"a": 84.495,
"b": 84.495,
"c": 144.292,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.98085],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [90.000,1.750],
"number_observations_unique": 53547,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.099
},
{
"type": "I/SigI",
"value": 16.9580
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 12.300
}
]
},
"refln_shells": [
{
"resolution_limits": [1.89,1.75],
"number_observations_unique": 10547,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.431
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 12.00
}
]
},
{
"resolution_limits": [2.07,1.89],
"number_observations_unique": 10556,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.218
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 12.60
}
]
},
{
"resolution_limits": [2.38,2.07],
"number_observations_unique": 10623,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.153
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 12.60
}
]
},
{
"resolution_limits": [2.99,2.38],
"number_observations_unique": 10740,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.125
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 12.60
}
]
},
{
"resolution_limits": [90.00,2.99],
"number_observations_unique": 11081,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.097
},
{
"type": "Completeness",
"value": 99.00
},
{
"type": "Redundancy",
"value": 11.80
}
]
}
]
}