Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "40f3107adb933425b8f8142ee3c59e01",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 62.57,
"b": 79.32,
"c": 89.35,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91589],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [62.570,1.350],
"number_observations": 635875,
"number_observations_unique": 97389,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.098
},
{
"type": "R(meas)",
"value": 0.106
},
{
"type": "R(pim)",
"value": 0.041
},
{
"type": "I/SigI",
"value": 10.000
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 6.500
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.390,1.350],
"number_observations": 40970,
"number_observations_unique": 7045,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.611
},
{
"type": "R(meas)",
"value": 1.770
},
{
"type": "R(pim)",
"value": 0.724
},
{
"type": "I/SigI",
"value": 1.000
},
{
"type": "Completeness",
"value": 98.400
},
{
"type": "Redundancy",
"value": 5.800
},
{
"type": "CC(1/2)",
"value": 0.459
}
]
},
{
"resolution_limits": [62.570,6.040],
"number_observations": 7879,
"number_observations_unique": 1250,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.037
},
{
"type": "R(meas)",
"value": 0.041
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 35.000
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 6.300
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}