Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ae52e9aabe81059688e38767c0dcb2d0",
"space_group_name": "P 43",
"unit_cell": {
"a": 87.918,
"b": 87.918,
"c": 39.007,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91257],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [87.930,1.110],
"number_observations": 664427,
"number_observations_unique": 117995,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.115
},
{
"type": "R(meas)",
"value": 0.125
},
{
"type": "R(pim)",
"value": 0.050
},
{
"type": "I/SigI",
"value": 5.100
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 5.600
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.130,1.110],
"number_observations": 20454,
"number_observations_unique": 5714,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.614
},
{
"type": "R(meas)",
"value": 1.894
},
{
"type": "R(pim)",
"value": 0.974
},
{
"type": "I/SigI",
"value": 0.400
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 3.600
},
{
"type": "CC(1/2)",
"value": 0.455
}
]
},
{
"resolution_limits": [87.930,6.080],
"number_observations": 5360,
"number_observations_unique": 795,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.067
},
{
"type": "R(meas)",
"value": 0.072
},
{
"type": "R(pim)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 15.100
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.700
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
}
]
}