Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3a1b348bfa102b3e2a1a696a43ce1874",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 50.837,
"b": 81.980,
"c": 110.768,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.95600],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [37.370,1.700],
"number_observations": 362268,
"number_observations_unique": 51552,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.647
},
{
"type": "R(meas)",
"value": 0.699
},
{
"type": "R(pim)",
"value": 0.261
},
{
"type": "I/SigI",
"value": 6.600
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 7.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.790,1.700],
"number_observations": 52803,
"number_observations_unique": 7411,
"quality_factors": [
{
"type": "R(merge)",
"value": 7.345
},
{
"type": "R(pim)",
"value": 0.036
},
{
"type": "I/SigI",
"value": 1.900
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 7.100
}
]
},
{
"resolution_limits": [37.370,5.380],
"number_observations": 11906,
"number_observations_unique": 1800,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.086
},
{
"type": "R(pim)",
"value": 0.038
},
{
"type": "I/SigI",
"value": 14.300
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 6.600
}
]
}
]
}