Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "759ff9f1b26e0b84920460a400a8073d",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 101.155,
"b": 102.373,
"c": 127.504,
"alpha": 90.00,
"beta": 106.29,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.55,1.80],
"number_observations_unique": 426838,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.074
},
{
"type": "R(meas)",
"value": 0.081
},
{
"type": "R(pim)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 14.8
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.83,1.80],
"number_observations": 79769,
"number_observations_unique": 11331,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.190
},
{
"type": "R(meas)",
"value": 1.286
},
{
"type": "R(pim)",
"value": 0.483
},
{
"type": "I/SigI",
"value": 1.6
},
{
"type": "Redundancy",
"value": 7.0
},
{
"type": "CC(1/2)",
"value": 0.628
}
]
}
]
}