Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b05442e77af9d4fa0449d737227f9a43",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 19.607,
"b": 4.839,
"c": 43.220,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.94660],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [90.000,1.500],
"number_observations_unique": 753,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.181
},
{
"type": "I/SigI",
"value": 5.800
},
{
"type": "Completeness",
"value": 93.800
},
{
"type": "Redundancy",
"value": 13.100
}
]
},
"refln_shells": [
{
"resolution_limits": [1.620,1.500],
"number_observations_unique": 128,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.422
},
{
"type": "Completeness",
"value": 81.000
},
{
"type": "Redundancy",
"value": 8.800
}
]
},
{
"resolution_limits": [1.780,1.620],
"number_observations_unique": 129,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.378
},
{
"type": "Completeness",
"value": 94.200
},
{
"type": "Redundancy",
"value": 9.700
}
]
},
{
"resolution_limits": [2.040,1.780],
"number_observations_unique": 146,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.242
},
{
"type": "Completeness",
"value": 96.700
},
{
"type": "Redundancy",
"value": 16.400
}
]
},
{
"resolution_limits": [2.560,2.040],
"number_observations_unique": 163,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.196
},
{
"type": "Completeness",
"value": 96.400
},
{
"type": "Redundancy",
"value": 15.700
}
]
},
{
"resolution_limits": [90.000,2.560],
"number_observations_unique": 187,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.125
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 13.800
}
]
}
]
}