Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "706ac131192e9b48afc2b4e48fbb0d6c",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 38.065,
"b": 43.889,
"c": 56.104,
"alpha": 90.00,
"beta": 94.19,
"gamma": 90.00
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [37.96,1.70],
"number_observations": 37808,
"number_observations_unique": 20474,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.033
},
{
"type": "R(meas)",
"value": 0.046
},
{
"type": "R(pim)",
"value": 0.033
},
{
"type": "I/SigI",
"value": 13.9
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 1.8
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.73,1.70],
"number_observations": 1824,
"number_observations_unique": 1064,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.144
},
{
"type": "R(meas)",
"value": 0.203
},
{
"type": "R(pim)",
"value": 0.144
},
{
"type": "I/SigI",
"value": 5.0
},
{
"type": "Redundancy",
"value": 1.7
},
{
"type": "CC(1/2)",
"value": 0.937
}
]
}
]
}