Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e6f66ce6c16935856c8a698ab4a42d8f",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 40.376,
"b": 61.213,
"c": 87.678,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97949],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [61.213,1.517],
"number_observations": 149322,
"number_observations_unique": 32571,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.087
},
{
"type": "R(meas)",
"value": 0.098
},
{
"type": "R(pim)",
"value": 0.043
},
{
"type": "I/SigI",
"value": 12.500
},
{
"type": "Completeness",
"value": 94.600
},
{
"type": "Redundancy",
"value": 4.600
}
]
},
"refln_shells": [
{
"resolution_limits": [1.522,1.517],
"number_observations_unique": 351,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.672
},
{
"type": "R(meas)",
"value": 0.756
},
{
"type": "R(pim)",
"value": 0.338
},
{
"type": "Completeness",
"value": 97.500
},
{
"type": "Redundancy",
"value": 4.600
}
]
},
{
"resolution_limits": [61.213,7.037],
"number_observations_unique": 346,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.022
},
{
"type": "R(meas)",
"value": 0.025
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "Completeness",
"value": 84.400
},
{
"type": "Redundancy",
"value": 4.400
}
]
}
]
}