Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "80f6782d415c67929c448c6ebe1ee9fd",
"space_group_name": "I 1 2 1",
"unit_cell": {
"a": 70.370,
"b": 53.338,
"c": 133.903,
"alpha": 90.00,
"beta": 93.53,
"gamma": 90.00
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [42.480,1.360],
"number_observations_unique": 67898,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.050
},
{
"type": "R(meas)",
"value": 0.054
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 32.900
},
{
"type": "Completeness",
"value": 64.200
},
{
"type": "Redundancy",
"value": 8.000
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.390,1.360],
"quality_factors": [
{
"type": "R(merge)",
"value": 3.069
},
{
"type": "R(meas)",
"value": 3.679
},
{
"type": "R(pim)",
"value": 1.985
},
{
"type": "Completeness",
"value": 4.200
},
{
"type": "Redundancy",
"value": 2.900
},
{
"type": "CC(1/2)",
"value": 0.511
}
]
},
{
"resolution_limits": [42.480,7.460],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.036
},
{
"type": "R(meas)",
"value": 0.039
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "Completeness",
"value": 95.100
},
{
"type": "Redundancy",
"value": 7.000
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}