Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "2c3ff2d2daeeda9bf6fd3b989a245c06",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.264,
"b": 88.264,
"c": 39.228,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91188],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [88.280,1.090],
"number_observations": 716896,
"number_observations_unique": 126110,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.093
},
{
"type": "R(meas)",
"value": 0.102
},
{
"type": "R(pim)",
"value": 0.041
},
{
"type": "I/SigI",
"value": 6.500
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 5.700
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.110,1.090],
"number_observations": 22235,
"number_observations_unique": 6366,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.728
},
{
"type": "R(meas)",
"value": 2.047
},
{
"type": "R(pim)",
"value": 1.080
},
{
"type": "I/SigI",
"value": 0.500
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 3.500
},
{
"type": "CC(1/2)",
"value": 0.400
}
]
},
{
"resolution_limits": [88.280,5.870],
"number_observations": 5977,
"number_observations_unique": 889,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.070
},
{
"type": "R(meas)",
"value": 0.076
},
{
"type": "R(pim)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 22.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.700
},
{
"type": "CC(1/2)",
"value": 0.987
}
]
}
]
}