Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "624d139043e3e4f76af6b02e2a1458dd",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 98.838,
"b": 111.550,
"c": 160.072,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.95000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.130,2.030],
"number_observations_unique": 114257,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.060
},
{
"type": "I/SigI",
"value": 16.800
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.400
}
]
},
"refln_shells": [
{
"resolution_limits": [2.070,2.030],
"number_observations": 34914,
"number_observations_unique": 5529,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.797
},
{
"type": "I/SigI",
"value": 2.000
},
{
"type": "Completeness",
"value": 98.100
},
{
"type": "Redundancy",
"value": 6.300
}
]
},
{
"resolution_limits": [48.130,11.130],
"number_observations": 3904,
"number_observations_unique": 779,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 55.400
},
{
"type": "Completeness",
"value": 96.800
},
{
"type": "Redundancy",
"value": 5.000
}
]
}
]
}