Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7cc8d81c3bc8872619615f2f8b8f773f",
"space_group_name": "H 3",
"unit_cell": {
"a": 103.590,
"b": 103.590,
"c": 72.132,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.54180],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.000,1.800],
"number_observations_unique": 26794,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.093
},
{
"type": "I/SigI",
"value": 12.600
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 4.200
}
]
},
"refln_shells": [
{
"resolution_limits": [1.86,1.80],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.809
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 4.00
}
]
},
{
"resolution_limits": [1.94,1.86],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.647
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 4.10
}
]
},
{
"resolution_limits": [2.03,1.94],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.481
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 4.10
}
]
},
{
"resolution_limits": [2.13,2.03],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.327
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 4.10
}
]
},
{
"resolution_limits": [2.27,2.13],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.229
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 4.20
}
]
},
{
"resolution_limits": [2.44,2.27],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.171
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 4.20
}
]
},
{
"resolution_limits": [2.69,2.44],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.120
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 4.20
}
]
},
{
"resolution_limits": [3.08,2.69],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.084
},
{
"type": "Completeness",
"value": 99.90
},
{
"type": "Redundancy",
"value": 4.30
}
]
},
{
"resolution_limits": [3.88,3.08],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.061
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 4.30
}
]
},
{
"resolution_limits": [50.00,3.88],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.048
},
{
"type": "Completeness",
"value": 99.90
},
{
"type": "Redundancy",
"value": 4.30
}
]
}
]
}