Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ba32c092b9f45277b3e0e69a69064e88",
"space_group_name": "I 2 2 2",
"unit_cell": {
"a": 79.376,
"b": 120.711,
"c": 170.003,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.03300],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.21,2.300],
"number_observations_unique": 36691,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.1146
},
{
"type": "R(meas)",
"value": 0.129
},
{
"type": "R(pim)",
"value": 0.049
},
{
"type": "I/SigI",
"value": 13.43
},
{
"type": "Completeness",
"value": 99.94
},
{
"type": "Redundancy",
"value": 6.800
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.382,2.300],
"quality_factors": [
{
"type": "R(merge)",
"value": 1.227
},
{
"type": "R(meas)",
"value": 1.414
},
{
"type": "R(pim)",
"value": 0.540
},
{
"type": "I/SigI",
"value": 1.57
},
{
"type": "Completeness",
"value": 99.97
},
{
"type": "Redundancy",
"value": 6.800
},
{
"type": "CC(1/2)",
"value": 0.665
}
]
}
]
}