Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ec346c1ec15278b661ccae8823b845b7",
"space_group_name": "P 61 2 2",
"unit_cell": {
"a": 180.892,
"b": 180.892,
"c": 555.884,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.890,3.150],
"number_observations": 1537361,
"number_observations_unique": 93823,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.247
},
{
"type": "R(meas)",
"value": 0.255
},
{
"type": "R(pim)",
"value": 0.062
},
{
"type": "I/SigI",
"value": 11.900
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 16.400
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [3.200,3.150],
"number_observations": 74659,
"number_observations_unique": 4549,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.811
},
{
"type": "R(meas)",
"value": 2.900
},
{
"type": "R(pim)",
"value": 0.708
},
{
"type": "I/SigI",
"value": 1.300
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 16.400
},
{
"type": "CC(1/2)",
"value": 0.393
}
]
},
{
"resolution_limits": [49.890,17.250],
"number_observations": 9326,
"number_observations_unique": 696,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.045
},
{
"type": "R(meas)",
"value": 0.046
},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "I/SigI",
"value": 41.200
},
{
"type": "Completeness",
"value": 95.900
},
{
"type": "Redundancy",
"value": 13.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}