Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "97b7f94fee0f1cafdc810d8b821a80c6",
"space_group_name": "P 21 21 2",
"unit_cell": {
"a": 111.217,
"b": 228.075,
"c": 58.459,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.0,2.69],
"number_observations_unique": 47752,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.163
},
{
"type": "I/SigI",
"value": 13.8
},
{
"type": "Completeness",
"value": 91.5
},
{
"type": "Redundancy",
"value": 6.2
}
]
},
"refln_shells": [
{
"resolution_limits": [2.82,2.69],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.891
},
{
"type": "Completeness",
"value": 86.5
}
]
},
{
"resolution_limits": [2.96,2.82],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.703
},
{
"type": "Completeness",
"value": 86.4
}
]
},
{
"resolution_limits": [3.15,2.96],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.466
},
{
"type": "Completeness",
"value": 87.1
}
]
},
{
"resolution_limits": [3.39,3.15],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.301
},
{
"type": "Completeness",
"value": 90.3
}
]
},
{
"resolution_limits": [3.73,3.39],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.218
},
{
"type": "Completeness",
"value": 95.0
}
]
},
{
"resolution_limits": [4.27,3.73],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.174
},
{
"type": "Completeness",
"value": 98.4
}
]
}
]
}