Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "74d903a2f3514db3959e77439b7bb8cb",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 48.694,
"b": 256.408,
"c": 48.551,
"alpha": 90.00,
"beta": 117.34,
"gamma": 90.00
},
"wavelengths": [0.82661],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.129,2.100],
"number_observations": 147290,
"number_observations_unique": 51979,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.049
},
{
"type": "R(meas)",
"value": 0.074
},
{
"type": "R(pim)",
"value": 0.041
},
{
"type": "I/SigI",
"value": 10.500
},
{
"type": "Completeness",
"value": 85.000
},
{
"type": "Redundancy",
"value": 2.800
}
]
},
"refln_shells": [
{
"resolution_limits": [2.21,2.10],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.417
},
{
"type": "I/SigI",
"value": 1.7
},
{
"type": "Completeness",
"value": 77.00
},
{
"type": "Redundancy",
"value": 2.80
}
]
},
{
"resolution_limits": [2.35,2.21],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.316
},
{
"type": "I/SigI",
"value": 2.3
},
{
"type": "Completeness",
"value": 82.00
},
{
"type": "Redundancy",
"value": 2.70
}
]
},
{
"resolution_limits": [2.51,2.35],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.224
},
{
"type": "I/SigI",
"value": 3.2
},
{
"type": "Completeness",
"value": 85.60
},
{
"type": "Redundancy",
"value": 2.70
}
]
},
{
"resolution_limits": [2.71,2.51],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.158
},
{
"type": "I/SigI",
"value": 4.5
},
{
"type": "Completeness",
"value": 87.20
},
{
"type": "Redundancy",
"value": 2.70
}
]
},
{
"resolution_limits": [2.97,2.71],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.105
},
{
"type": "I/SigI",
"value": 6.4
},
{
"type": "Completeness",
"value": 88.90
},
{
"type": "Redundancy",
"value": 2.80
}
]
},
{
"resolution_limits": [3.32,2.97],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.064
},
{
"type": "I/SigI",
"value": 9.6
},
{
"type": "Completeness",
"value": 85.80
},
{
"type": "Redundancy",
"value": 2.80
}
]
},
{
"resolution_limits": [3.83,3.32],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.044
},
{
"type": "I/SigI",
"value": 12.4
},
{
"type": "Completeness",
"value": 89.00
},
{
"type": "Redundancy",
"value": 3.00
}
]
},
{
"resolution_limits": [4.70,3.83],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.034
},
{
"type": "I/SigI",
"value": 14.8
},
{
"type": "Completeness",
"value": 89.00
},
{
"type": "Redundancy",
"value": 3.10
}
]
},
{
"resolution_limits": [6.64,4.70],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.029
},
{
"type": "I/SigI",
"value": 16.0
},
{
"type": "Completeness",
"value": 88.90
},
{
"type": "Redundancy",
"value": 3.00
}
]
},
{
"resolution_limits": [43.13,6.64],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 9.7
},
{
"type": "Completeness",
"value": 81.20
},
{
"type": "Redundancy",
"value": 3.00
}
]
}
]
}