Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "857a557393adb8c1a24ac3836556adc0",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 71.212,
"b": 71.212,
"c": 150.140,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.320,1.450],
"number_observations": 889598,
"number_observations_unique": 69166,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.057
},
{
"type": "R(meas)",
"value": 0.059
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 26.500
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 12.900
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.480,1.450],
"number_observations": 36802,
"number_observations_unique": 3432,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.816
},
{
"type": "R(meas)",
"value": 0.856
},
{
"type": "R(pim)",
"value": 0.254
},
{
"type": "I/SigI",
"value": 3.000
},
{
"type": "Completeness",
"value": 95.300
},
{
"type": "Redundancy",
"value": 10.700
},
{
"type": "CC(1/2)",
"value": 0.847
}
]
},
{
"resolution_limits": [29.320,7.670],
"number_observations": 6175,
"number_observations_unique": 573,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.029
},
{
"type": "R(meas)",
"value": 0.031
},
{
"type": "R(pim)",
"value": 0.009
},
{
"type": "I/SigI",
"value": 75.700
},
{
"type": "Completeness",
"value": 98.200
},
{
"type": "Redundancy",
"value": 10.800
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}